Geometry & MOs

Info

ID:	65205
PubChem CID:	29204608
Reduced:	N3O3C21H23 (1)
Stoich.:	A3B3C21D23 (1)
Weight, g/mol:	376.093833
ΔH_f, kcal/mol:	-11.05
Dipole, Da:	9.25
IP(EA), eV:	-9.29(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-N'-[4-(4-nitroanilino)butanoyl]benzohydrazide

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)O[C@@H](C)C(=O)NC2=NON=C2C3=CC(=C(C=C3)C)C)C

DOS

IR

Vibrations