Geometry & MOs

Info

ID:	236128
PubChem CID:	92711693
Reduced:	SN2O3C25H28 (1)
Stoich.:	AB2C3D25E28 (1)
Weight, g/mol:	436.182064
ΔH_f, kcal/mol:	-69.81
Dipole, Da:	5.13
IP(EA), eV:	-8.21(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(7S)-3-ethyl-N,7-bis(4-methoxyphenyl)-2-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxamide

Drug info:

PubChemData

Smile

CCC1=C(SC2=C1CCN([C@@H]2C3=CC=C(C=C3)OC)C(=O)NC4=CC=C(C=C4)OC)C

DOS

IR

Vibrations