Geometry & MOs

Info

ID:	55405
PubChem CID:	17395343
Reduced:	N3O3C17H23 (1)
Stoich.:	A3B3C17D23 (1)
Weight, g/mol:	341.119798
ΔH_f, kcal/mol:	-144.95
Dipole, Da:	5.92
IP(EA), eV:	-8.67(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4,6-dimethyl-3-pyrrol-1-ylthieno[2,3-b]pyridin-2-yl)-morpholin-4-ylmethanone

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1)NC(=O)CCCN2C(=O)C(NC2=O)(C)C)C

DOS

IR

Vibrations