Geometry & MOs

Info

ID:	235438
PubChem CID:	92708903
Reduced:	OSN3C21H23 (1)
Stoich.:	ABC3D21E23 (1)
Weight, g/mol:	338.145285
ΔH_f, kcal/mol:	43.05
Dipole, Da:	3.15
IP(EA), eV:	-8.47(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-N-(3-phenylpropyl)-3-pyrrol-1-yl-3-thiophen-2-ylpropanamide

Drug info:

PubChemData

Smile

C1CN(CCN1C2=CC=CC=C2)C(=O)C[C@@H](C3=CC=CS3)N4C=CC=C4

DOS

IR

Vibrations