Geometry & MOs

Info

ID:	236073
PubChem CID:	92711453
Reduced:	NOSC24H27 (1)
Stoich.:	ABCD24E27 (1)
Weight, g/mol:	377.181336
ΔH_f, kcal/mol:	12.42
Dipole, Da:	2.69
IP(EA), eV:	-8.77(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(7S)-3-ethyl-2-methyl-6-(2-phenoxyethyl)-7-phenyl-5,7-dihydro-4H-thieno[2,3-c]pyridine

Drug info:

PubChemData

Smile

CCC1=C(SC2=C1CCN([C@@H]2C3=CC=CC=C3)CCOC4=CC=CC=C4)C

DOS

IR

Vibrations