Geometry & MOs

Info

ID:	38942
PubChem CID:	8138205
Reduced:	ClO3N4H13C14 (1)
Stoich.:	AB3C4D13E14 (1)
Weight, g/mol:	277.061804
ΔH_f, kcal/mol:	-60.82
Dipole, Da:	3.31
IP(EA), eV:	-9.36(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-[2-(2-chlorophenyl)acetyl]-1H-pyrrole-2-carbohydrazide

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)C(=O)NCC(=O)NNC(=O)C2=CC=CN2)Cl

DOS

IR

Vibrations