Geometry & MOs

Info

ID:

132018

PubChem CID:

51292288

Reduced:

SO2N5C20H25 (1)

Stoich.:

AB2C5D20E25 (1)

Weight, g/mol:

327.163457

ΔHf, kcal/mol:

-24.28

Dipole, Da:

3.72

IP(EA), eV:

-9.34(-1.27)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

2-(4-fluorophenyl)-N-[(2-methoxy-5-methylphenyl)methyl]-N-methylcyclopropane-1-carboxamide

Drug info:

PubChemData

Smile

CC(C)N1C2=C(C=N1)C(=CC(=N2)C3=CC=CS3)C(=O)NCC(=O)NC(C)(C)C

DOS

IR

Vibrations