Geometry & MOs

Info

ID:	84707
PubChem CID:	49869379
Reduced:	SO2N4C19H24 (1)
Stoich.:	AB2C4D19E24 (1)
Weight, g/mol:	412.176007
ΔH_f, kcal/mol:	-15.32
Dipole, Da:	5.82
IP(EA), eV:	-9.12(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(4-cyclopropylimidazol-1-yl)-N-[6-(4-cyclopropyl-1,2,4-triazol-3-yl)pyridin-2-yl]pyridine-2-carboxamide

Drug info:

PubChemData

Smile

C1CCC(CC1)NC2=NC=CC(=N2)C3=CC=C(C=C3)S(=O)(=O)NC4CC4

DOS

IR

Vibrations