Geometry & MOs

Info

ID:	93072
PubChem CID:	49991344
Reduced:	N4O5C31H42 (1)
Stoich.:	A4B5C31D42 (1)
Weight, g/mol:	518.325691
ΔH_f, kcal/mol:	-199.8
Dipole, Da:	6.5
IP(EA), eV:	-8.22(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-[5-(cyclohexylcarbamoyl)-2-methylanilino]-1-oxopropan-2-yl]-N-(2,6-dimethylphenyl)piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)C(=O)NC2CCCCC2)NC(=O)C(C)N3CCC(CC3)C(=O)NC4=C(C=C(C=C4)OC)OC

DOS

IR

Vibrations