Geometry & MOs

Info

ID:	236053
PubChem CID:	92711424
Reduced:	OSN2C24H32 (1)
Stoich.:	ABC2D24E32 (1)
Weight, g/mol:	370.207885
ΔH_f, kcal/mol:	-38.83
Dipole, Da:	2.25
IP(EA), eV:	-8.73(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-tert-butyl-2-[(7R)-3-ethyl-2-methyl-7-phenyl-5,7-dihydro-4H-thieno[2,3-c]pyridin-6-yl]acetamide

Drug info:

PubChemData

Smile

CCC1=C(SC2=C1CCN([C@H]2C3=CC=CC=C3)CC(=O)NC4CCCCC4)C

DOS

IR

Vibrations