Geometry & MOs

Info

ID:	315677
PubChem CID:	126628466
Reduced:	PO3C5H7 (2)
Stoich.:	AB3C5D7 (2)
Weight, g/mol:	126.079313
ΔH_f, kcal/mol:	-357.81
Dipole, Da:	2.55
IP(EA), eV:	-9.38(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methyl-6-methylidenepiperazin-2-one

Drug info:

PubChemData

Smile

C1P(=O)(OC(OP1(=O)O)CCC2=CC=CC=C2)O

DOS

IR

Vibrations