Geometry & MOs

Info

ID:	285860
PubChem CID:	104134028
Reduced:	ClO2N3C15H22 (1)
Stoich.:	AB2C3D15E22 (1)
Weight, g/mol:	309.043567
ΔH_f, kcal/mol:	-89.99
Dipole, Da:	2.02
IP(EA), eV:	-9.78(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-N-(2-chloropyridin-3-yl)-6-propan-2-ylpyridine-4-carboxamide

Drug info:

PubChemData

Smile

CCCNC(=O)CN(C)C(=O)C1=CC(=NC(=C1)Cl)C(C)C

DOS

IR

Vibrations