Geometry & MOs

Info

ID:	299462
PubChem CID:	117683073
Reduced:	NO2C14H21 (1)
Stoich.:	AB2C14D21 (1)
Weight, g/mol:	331.262363
ΔH_f, kcal/mol:	-81.43
Dipole, Da:	1.86
IP(EA), eV:	-9.06(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[4-[(3-tert-butylphenyl)methyl]piperazin-1-yl]ethyl]-N-methylacetamide

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC(=CN=C1)OC2CCOCC2

DOS

IR

Vibrations