Geometry & MOs

Info

ID:	123648
PubChem CID:	50857761
Reduced:	N2O2H16C19 (1)
Stoich.:	A2B2C16D19 (1)
Weight, g/mol:	319.132077
ΔH_f, kcal/mol:	10.11
Dipole, Da:	9.68
IP(EA), eV:	-8.85(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-methyl-3-nitrophenyl)-1-(5-methyl-1-phenylpyrrol-3-yl)methanimine

Drug info:

PubChemData

Smile

CC1=CC(=CN1C2=CC=CC=C2)C=NC3=CC=CC(=C3)C(=O)O

DOS

IR

Vibrations