Geometry & MOs

Info

ID:	157208
PubChem CID:	56422399
Reduced:	SO2N4C23H30 (1)
Stoich.:	AB2C4D23E30 (1)
Weight, g/mol:	355.14514
ΔH_f, kcal/mol:	-54.17
Dipole, Da:	11.67
IP(EA), eV:	-8.87(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-N-(1H-indol-5-yl)-N-(4-methylpentan-2-yl)pyridine-2-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C(=O)N=C(N1)SC)CCC(=O)N(C2=CC3=C(C=C2)NC=C3)C(C)CC(C)C

DOS

IR

Vibrations