Geometry & MOs

Info

ID:	175706
PubChem CID:	75939813
Reduced:	N2O2C20H27 (1)
Stoich.:	A2B2C20D27 (1)
Weight, g/mol:	326.199428
ΔH_f, kcal/mol:	-42.47
Dipole, Da:	2.64
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 1.012148
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(dimethylamino)-2-(4-ethylphenyl)ethyl]-2-(3-hydroxyphenyl)acetamide

Drug info:

PubChemData

Smile

CCC1=CC=C(C=C1)C(CNC(=O)CC2=CC(=CC=C2)O)[NH+](C)C

DOS

IR

Vibrations