Geometry & MOs

Info

ID:	269405
PubChem CID:	103617362
Reduced:	ON2C18H22 (1)
Stoich.:	AB2C18D22 (1)
Weight, g/mol:	252.129634
ΔH_f, kcal/mol:	-12.03
Dipole, Da:	2.73
IP(EA), eV:	-9.06(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,2-dimethyl-3-[(4-methylsulfanylphenyl)methylamino]propanamide

Drug info:

PubChemData

Smile

CC(C)(CNCC1=CC=C(C=C1)C2=CC=CC=C2)C(=O)N

DOS

IR

Vibrations