Geometry & MOs

Info

ID:	26716
PubChem CID:	794738
Reduced:	ON2H14C15 (1)
Stoich.:	AB2C14D15 (1)
Weight, g/mol:	336.158626
ΔH_f, kcal/mol:	20.42
Dipole, Da:	4.8
IP(EA), eV:	-9.32(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-tert-butyl-N-[(2-hydroxynaphthalen-1-yl)methylideneamino]-1H-pyrazole-3-carboxamide

Drug info:

PubChemData

Smile

CC1=CC=CC=C1C=NC2=CC=CC=C2C(=O)N

DOS

IR

Vibrations