Geometry & MOs

Info

ID:

442736

PubChem CID:

135256013

Reduced:

O2N8H24C25 (1)

Stoich.:

A2B8C24D25 (1)

Weight, g/mol:

610.244087

ΔHf, kcal/mol:

80.88

Dipole, Da:

8.1

IP(EA), eV:

 -9.5(-1.23)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[4-(3-cyanophenyl)-6-[2-[[6-[methoxy(phenyl)methyl]pyridin-2-yl]methylimino]ethanehydrazonoyl]pyrimidin-2-yl]-2-phenoxyacetamide

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC=CC(=N1)CN2C=C(N=N2)C3=NC(=NC(=C3)C4=CC=CC(=C4)C#N)NCC(=O)O

DOS

IR

Vibrations