Geometry & MOs

Info

ID:	252278
PubChem CID:	103110225
Reduced:	ON2C12H16 (1)
Stoich.:	AB2C12D16 (1)
Weight, g/mol:	288.129634
ΔH_f, kcal/mol:	-15.5
Dipole, Da:	5.19
IP(EA), eV:	-8.56(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3-amino-2-methylphenyl)methyl]-4-thiophen-2-ylbutanamide

Drug info:

PubChemData

Smile

CC1=C(C=CC=C1N)CNC(=O)C2CC2

DOS

IR

Vibrations