Geometry & MOs

Info

ID:	259494
PubChem CID:	103166791
Reduced:	BrNOC10H18 (1)
Stoich.:	ABCD10E18 (1)
Weight, g/mol:	345.13034
ΔH_f, kcal/mol:	-67.3
Dipole, Da:	4.52
IP(EA), eV:	-9.92(0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(bromomethyl)-4-methylcyclohexyl]-2-(3-ethoxycyclobutyl)acetamide

Drug info:

PubChemData

Smile

CC(CNC(=O)CC1CCC1)CBr

DOS

IR

Vibrations