Geometry & MOs

Info

ID:	74440
PubChem CID:	48421881
Reduced:	SN2O2C16H24 (1)
Stoich.:	AB2C2D16E24 (1)
Weight, g/mol:	376.211055
ΔH_f, kcal/mol:	-46.43
Dipole, Da:	2.94
IP(EA), eV:	-8.81(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl N-[1-[4-[2-(dimethylamino)-2-oxoethyl]piperazin-1-yl]-1-oxo-3-phenylpropan-2-yl]carbamate

Drug info:

PubChemData

Smile

CC(C(=O)N1CCN(CC1)CC2=CC=CS2)OCC3CC3

DOS

IR

Vibrations