Geometry & MOs

Info

ID:	283229
PubChem CID:	103966011
Reduced:	ON2C17H34 (1)
Stoich.:	AB2C17D34 (1)
Weight, g/mol:	295.133907
ΔH_f, kcal/mol:	-99.98
Dipole, Da:	2.62
IP(EA), eV:	-8.7(2.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(chloromethyl)-N-[[1-(hydroxymethyl)cyclohexyl]methyl]benzamide

Drug info:

PubChemData

Smile

CC(CC1CCCCCN1)NCC2(CCCCC2)CO

DOS

IR

Vibrations