Geometry & MOs

Info

ID:	272550
PubChem CID:	103745038
Reduced:	OCl2N3H7C10 (1)
Stoich.:	AB2C3D7E10 (1)
Weight, g/mol:	250.062139
ΔH_f, kcal/mol:	3.84
Dipole, Da:	1.89
IP(EA), eV:	-9.36(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-chloropyridin-3-yl)-3-pyrazol-1-ylpropanamide

Drug info:

PubChemData

Smile

C1=CN=CC(=C1Cl)NC(=O)C2=CC(=CN2)Cl

DOS

IR

Vibrations