Geometry & MOs

Info

ID:	74284
PubChem CID:	48421676
Reduced:	N2O5C21H26 (1)
Stoich.:	A2B5C21D26 (1)
Weight, g/mol:	305.173942
ΔH_f, kcal/mol:	-163.87
Dipole, Da:	4.44
IP(EA), eV:	-8.59(-0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CN(CC1=C(C(=CC=C1)OC)OC)C(=O)C(CC2=CC=CC=C2)NC(=O)OC

DOS

IR

Vibrations