Geometry & MOs

Info

ID:	233938
PubChem CID:	92252605
Reduced:	SO2N3C19H25 (1)
Stoich.:	AB2C3D19E25 (1)
Weight, g/mol:	331.135448
ΔH_f, kcal/mol:	-61.46
Dipole, Da:	2.07
IP(EA), eV:	-8.38(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-N-cyclopropyl-1-(4-methylthieno[3,2-b]pyrrole-5-carbonyl)piperidine-3-carboxamide

Drug info:

PubChemData

Smile

CN1C2=C(C=C1C(=O)N3CCC[C@@H](C3)C(=O)NC4CCCC4)SC=C2

DOS

IR

Vibrations