Geometry & MOs

Info

ID:	325169
PubChem CID:	126681732
Reduced:	OSN2C17H22 (1)
Stoich.:	ABC2D17E22 (1)
Weight, g/mol:	278.145285
ΔH_f, kcal/mol:	28.33
Dipole, Da:	3.34
IP(EA), eV:	-8.44(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(NE)-N-(3-cyclopropyl-1-pyridin-4-ylpropylidene)-2-methylpropane-2-sulfinamide

Drug info:

PubChemData

Smile

CC(C)(C)S(=O)/N=C(\CCC1CC1)/C2=CC=C(C=C2)C#N

DOS

IR

Vibrations