Geometry & MOs

Info

ID:	257213
PubChem CID:	103144410
Reduced:	OBr2N2H14C15 (1)
Stoich.:	AB2C2D14E15 (1)
Weight, g/mol:	280.132411
ΔH_f, kcal/mol:	-6.67
Dipole, Da:	4.08
IP(EA), eV:	-7.96(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-amino-2,5-dimethylphenyl)pyrazolo[1,5-a]pyridine-3-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1NC(=O)C2=C(C=CC(=C2)Br)Br)C)N

DOS

IR

Vibrations