Geometry & MOs

Info

ID:	190125
PubChem CID:	77957992
Reduced:	NOC8H10 (2)
Stoich.:	ABC8D10 (2)
Weight, g/mol:	364.135782
ΔH_f, kcal/mol:	-8.06
Dipole, Da:	1.31
IP(EA), eV:	-8.6(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[5-(6-amino-1,3,4-trimethyl-2-oxopiperidin-4-yl)thiophen-3-yl]benzene-1,3-dicarbonitrile

Drug info:

PubChemData

Smile

C1CCN2CCC34C5=CC=CC=C5NC3(C2C1)OCO4

DOS

IR

Vibrations