Geometry & MOs

Info

ID:	265556
PubChem CID:	103529723
Reduced:	NOC16H21 (1)
Stoich.:	ABC16D21 (1)
Weight, g/mol:	310.144806
ΔH_f, kcal/mol:	9.45
Dipole, Da:	2.89
IP(EA), eV:	-8.78(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-chloro-2-(ethylamino)-N-[(4-methyloxan-4-yl)methyl]benzamide

Drug info:

PubChemData

Smile

CC(C1CCN(CC1)CC#CC2=CC=CC=C2)O

DOS

IR

Vibrations