Geometry & MOs

Info

ID:	176771
PubChem CID:	76096752
Reduced:	O4N5C29H33 (1)
Stoich.:	A4B5C29D33 (1)
Weight, g/mol:	365.081016
ΔH_f, kcal/mol:	-91.14
Dipole, Da:	3.36
IP(EA), eV:	-9.4(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2-benzylhydrazinyl)-6-(3,4-dichlorophenyl)-1,3,5-triazinan-2-one

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)CN(C(CCCN=C(N)N)C(=O)NCC(=O)O)C(=O)C(C2=CC=CC=C2)C3=CC=CC=C3

DOS

IR

Vibrations