Geometry & MOs

Info

ID:	75183
PubChem CID:	48423134
Reduced:	O2N3C15H29 (1)
Stoich.:	A2B3C15D29 (1)
Weight, g/mol:	390.263091
ΔH_f, kcal/mol:	-85.8
Dipole, Da:	3.45
IP(EA), eV:	-8.26(1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCN1CCN(CC1)CCNC(=O)C(C)OCC2CC2

DOS

IR

Vibrations