Geometry & MOs

Info

ID:	173933
PubChem CID:	75702632
Reduced:	N2O3C31H42 (1)
Stoich.:	A2B3C31D42 (1)
Weight, g/mol:	494.278072
ΔH_f, kcal/mol:	-107.91
Dipole, Da:	5.22
IP(EA), eV:	-9.26(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(1,3-benzodioxol-5-yl)-2-(cyclohexylamino)-2-oxoethyl]-3-cyclohexyl-N-(furan-2-ylmethyl)propanamide

Drug info:

PubChemData

Smile

CC1C(CC2CC1C2(C)C)C(=O)N(CC3=CC=CO3)C(C4=CC=CC=C4C)C(=O)NC5CCCCC5

DOS

IR

Vibrations