Geometry & MOs

Info

ID:	393439
PubChem CID:	135020598
Reduced:	N2H12C13 (1)
Stoich.:	A2B12C13 (1)
Weight, g/mol:	298.095357
ΔH_f, kcal/mol:	99.81
Dipole, Da:	4.94
IP(EA), eV:	-8.8(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (Z)-3-(4-nitroanilino)-3-phenylprop-2-enoate

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C#CN2C=CN=C2C

DOS

IR

Vibrations