Geometry & MOs

Info

ID:	74850
PubChem CID:	48422586
Reduced:	NO4C17H23 (1)
Stoich.:	AB4C17D23 (1)
Weight, g/mol:	375.215806
ΔH_f, kcal/mol:	-125.91
Dipole, Da:	2.78
IP(EA), eV:	-8.82(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCN(CC1=CC2=C(C=C1)OCO2)C(=O)C(C)OCC3CC3

DOS

IR

Vibrations