Geometry & MOs

Info

ID:	75555
PubChem CID:	48423653
Reduced:	O3N4C22H24 (1)
Stoich.:	A3B4C22D24 (1)
Weight, g/mol:	389.231456
ΔH_f, kcal/mol:	-47.97
Dipole, Da:	3.5
IP(EA), eV:	-9.45(-0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl N-[1-[3-(2-methylpropylcarbamoyl)piperidin-1-yl]-1-oxo-3-phenylpropan-2-yl]carbamate

Drug info:

PubChemData

Smile

COC(=O)NC(CC1=CC=CC=C1)C(=O)NCC2=CN(N=C2)CC3=CC=CC=C3

DOS

IR

Vibrations