Geometry & MOs

Info

ID:	237682
PubChem CID:	92720648
Reduced:	N3O4C19H29 (1)
Stoich.:	A3B4C19D29 (1)
Weight, g/mol:	435.198048
ΔH_f, kcal/mol:	-141.78
Dipole, Da:	5.1
IP(EA), eV:	-7.95(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-ethylthieno[3,2-b]pyrrole-5-carbonyl)-N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CCOC(=O)N1CCC(CC1)NC2=C(C(=O)C2=O)N3C[C@@H](C[C@H](C3)C)C

DOS

IR

Vibrations