Geometry & MOs

Info

ID:	194953
PubChem CID:	78612690
Reduced:	N2O4H18C19 (1)
Stoich.:	A2B4C18D19 (1)
Weight, g/mol:	303.077454
ΔH_f, kcal/mol:	-84.72
Dipole, Da:	4.8
IP(EA), eV:	-9.29(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-[3-(3-chloro-4-methylphenyl)prop-2-enoyl]-1H-pyrrole-2-carbohydrazide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C2=NN=C(O2)C(C)OC(=O)C3=CC=CC(=C3O)C

DOS

IR

Vibrations