Geometry & MOs

Info

ID:	175694
PubChem CID:	75938318
Reduced:	O3N4C25H43 (1)
Stoich.:	A3B4C25D43 (1)
Weight, g/mol:	446.325691
ΔH_f, kcal/mol:	-166.18
Dipole, Da:	6.73
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.752405
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(cyclohexylmethyl)piperidin-4-yl]-2-(7,7,9-trimethyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetamide

Drug info:

PubChemData

Smile

CC1CC(CC2(C1)C(=O)N(C(=O)N2)CC(=O)NC3CC[NH+](CC3)CC4CCCCC4)(C)C

DOS

IR

Vibrations