Geometry & MOs

Info

ID:	16017
PubChem CID:	457881
Reduced:	N3O10C30H41 (1)
Stoich.:	A3B10C30D41 (1)
Weight, g/mol:	603.279195
ΔH_f, kcal/mol:	-363.15
Dipole, Da:	8.84
IP(EA), eV:	-8.75(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1,4-bis(3,4,5-trimethoxybenzoyl)piperazin-2-yl]methyl N-tert-butylcarbamate

Drug info:

PubChemData

Smile

CC(C)(C)NC(=O)OCC1CN(CCN1C(=O)C2=CC(=C(C(=C2)OC)OC)OC)C(=O)C3=CC(=C(C(=C3)OC)OC)OC

DOS

IR

Vibrations