Geometry & MOs

Info

ID:	373447
PubChem CID:	131315464
Reduced:	O4H8C9 (1)
Stoich.:	A4B8C9 (1)
Weight, g/mol:	231.083019
ΔH_f, kcal/mol:	-131.6
Dipole, Da:	4.37
IP(EA), eV:	-9.11(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-amino-2,6-dimethyl-4-thiophen-2-yl-1,4-dihydropyridine-3-carbonitrile

Drug info:

PubChemData

Smile

C1C(=O)C2=C(O1)C=CC(=C2CO)O

DOS

IR

Vibrations