Geometry & MOs

Info

ID:	235440
PubChem CID:	92708908
Reduced:	SN2O3H18C19 (1)
Stoich.:	AB2C3D18E19 (1)
Weight, g/mol:	260.098334
ΔH_f, kcal/mol:	-32.21
Dipole, Da:	1.46
IP(EA), eV:	-8.78(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-N-cyclopropyl-3-pyrrol-1-yl-3-thiophen-2-ylpropanamide

Drug info:

PubChemData

Smile

C1OC2=C(O1)C=C(C=C2)CNC(=O)C[C@H](C3=CC=CS3)N4C=CC=C4

DOS

IR

Vibrations