Geometry & MOs

Info

ID:	75190
PubChem CID:	48423145
Reduced:	O2N3C21H33 (1)
Stoich.:	A2B3C21D33 (1)
Weight, g/mol:	404.242356
ΔH_f, kcal/mol:	-65.83
Dipole, Da:	3.8
IP(EA), eV:	-7.99(0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl N-[1-[4-(4-carbamoylpiperidin-1-yl)butylamino]-1-oxo-3-phenylpropan-2-yl]carbamate

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)N2CCN(CC2)CCCNC(=O)C(C)OCC3CC3

DOS

IR

Vibrations