Geometry & MOs

Info

ID:	38834
PubChem CID:	8138016
Reduced:	O2N3C11H15 (1)
Stoich.:	A2B3C11D15 (1)
Weight, g/mol:	315.158292
ΔH_f, kcal/mol:	-53.02
Dipole, Da:	1.47
IP(EA), eV:	-9.32(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-(4-pentoxybenzoyl)-1H-pyrrole-2-carbohydrazide

Drug info:

PubChemData

Smile

C1CCC(C1)C(=O)NNC(=O)C2=CC=CN2

DOS

IR

Vibrations