Geometry & MOs

Info

ID:	35560
PubChem CID:	7980031
Reduced:	N2O3C24H24 (1)
Stoich.:	A2B3C24D24 (1)
Weight, g/mol:	321.147727
ΔH_f, kcal/mol:	-40.26
Dipole, Da:	2.05
IP(EA), eV:	-9.15(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-(4-tert-butylbenzoyl)-4-cyanobenzohydrazide

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC=C(C=C1)C(=O)NNC(=O)C2=CC(=CC=C2)OC3=CC=CC=C3

DOS

IR

Vibrations