Geometry & MOs

Info

ID:	264666
PubChem CID:	103481393
Reduced:	BrOCl2N3H10C13 (1)
Stoich.:	ABC2D3E10F13 (1)
Weight, g/mol:	367.0087
ΔH_f, kcal/mol:	-0.42
Dipole, Da:	4.48
IP(EA), eV:	-9.07(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-N-(2-bromo-3-chlorophenyl)-6-propan-2-ylpyridine-4-carboxamide

Drug info:

PubChemData

Smile

CNC1=C(C=C(C=N1)C(=O)NC2=C(C(=CC=C2)Cl)Br)Cl

DOS

IR

Vibrations