Geometry & MOs

Info

ID:	433981
PubChem CID:	135174131
Reduced:	NO3C15H16 (2)
Stoich.:	AB3C15D16 (2)
Weight, g/mol:	416.209993
ΔH_f, kcal/mol:	-184.94
Dipole, Da:	6.27
IP(EA), eV:	-9.19(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-hydroxyethyl 4-tritylpiperazine-1-carboxylate

Drug info:

PubChemData

Smile

C1CN(CCN1C(=O)OCCOC(=O)CCC(=O)O)C(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4

DOS

IR

Vibrations