Geometry & MOs

Info

ID:	235441
PubChem CID:	92708924
Reduced:	OSN2C14H16 (1)
Stoich.:	ABC2D14E16 (1)
Weight, g/mol:	340.124549
ΔH_f, kcal/mol:	25.77
Dipole, Da:	1.63
IP(EA), eV:	-9.08(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-N-[(3-methoxyphenyl)methyl]-3-pyrrol-1-yl-3-thiophen-2-ylpropanamide

Drug info:

PubChemData

Smile

C1CC1NC(=O)C[C@H](C2=CC=CS2)N3C=CC=C3

DOS

IR

Vibrations