Geometry & MOs

Info

ID:	236914
PubChem CID:	92715904
Reduced:	NSO2H21C22 (1)
Stoich.:	ABC2D21E22 (1)
Weight, g/mol:	365.108565
ΔH_f, kcal/mol:	-24.61
Dipole, Da:	4.22
IP(EA), eV:	-8.55(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(7R)-3-(2-methoxyphenyl)-7-(3-methoxyphenyl)-6,7-dihydro-4H-thieno[3,2-b]pyridin-5-one

Drug info:

PubChemData

Smile

CCCOC1=CC=C(C=C1)[C@H]2CC(=O)NC3=C2SC=C3C4=CC=CC=C4

DOS

IR

Vibrations