Geometry & MOs

Info

ID:	235435
PubChem CID:	92708883
Reduced:	OSN2C19H20 (1)
Stoich.:	ABC2D19E20 (1)
Weight, g/mol:	300.093249
ΔH_f, kcal/mol:	22.43
Dipole, Da:	3.87
IP(EA), eV:	-8.83(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCC1=CC=C(C=C1)NC(=O)C[C@@H](C2=CC=CS2)N3C=CC=C3

DOS

IR

Vibrations