Geometry & MOs

Info

ID:	257387
PubChem CID:	103145690
Reduced:	N2O3C16H16 (1)
Stoich.:	A2B3C16D16 (1)
Weight, g/mol:	286.10659
ΔH_f, kcal/mol:	-17.31
Dipole, Da:	1.94
IP(EA), eV:	-9.38(-1.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-N-(2,5-dimethyl-4-nitrophenyl)pyridine-3-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1[N+](=O)[O-])C)N2C=CC3=C2CCCC3=O

DOS

IR

Vibrations