Geometry & MOs

Info

ID:	324278
PubChem CID:	126677291
Reduced:	N2O2C15H16 (1)
Stoich.:	A2B2C15D16 (1)
Weight, g/mol:	379.223608
ΔH_f, kcal/mol:	-17.32
Dipole, Da:	4.52
IP(EA), eV:	-8.91(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-[dimethylamino(methoxy)phosphoryl]piperazin-1-yl]-2-(3-hydroxy-3-methylbutoxy)-2-methylpropan-1-one

Drug info:

PubChemData

Smile

CCOC(=O)C(=C)/C=C\N1C(=NC2=CC=CC=C21)C

DOS

IR

Vibrations