Geometry & MOs

Info

ID:	196200
PubChem CID:	78795901
Reduced:	BrNO2C15H24 (1)
Stoich.:	ABC2D15E24 (1)
Weight, g/mol:	291.183444
ΔH_f, kcal/mol:	-141.34
Dipole, Da:	4.11
IP(EA), eV:	-10.04(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-cyclohexyl-N-[2-(3,4-dihydroxyphenyl)ethyl]propanamide

Drug info:

PubChemData

Smile

C1C2CC3(CC1CC(C2)(C3)Br)CC(=O)NCCCO

DOS

IR

Vibrations