Geometry & MOs

Info

ID:	353306
PubChem CID:	127284635
Reduced:	O2N3C17H21 (1)
Stoich.:	A2B3C17D21 (1)
Weight, g/mol:	365.177313
ΔH_f, kcal/mol:	-39.14
Dipole, Da:	2.89
IP(EA), eV:	-8.96(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-N-[2-(3-methylmorpholin-4-yl)ethyl]-4-oxobutanamide

Drug info:

PubChemData

Smile

CC1COCCN1CCNC(=O)C2=CN=CC3=CC=CC=C32

DOS

IR

Vibrations