Geometry & MOs

Info

ID:	131486
PubChem CID:	51212398
Reduced:	FNSO3C20H22 (1)
Stoich.:	ABCD3E20F22 (1)
Weight, g/mol:	346.135114
ΔH_f, kcal/mol:	-142.53
Dipole, Da:	3.06
IP(EA), eV:	-8.8(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-[1-(2-methoxy-5-methylphenyl)ethylamino]-3-oxopropyl]thiophene-2-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)OC)C(C)NC(=O)CSC2=C(C=C(C=C2)C(=O)C)F

DOS

IR

Vibrations