Geometry & MOs

Info

ID:	352419
PubChem CID:	127283507
Reduced:	O4N5C18H27 (1)
Stoich.:	A4B5C18D27 (1)
Weight, g/mol:	359.220892
ΔH_f, kcal/mol:	-158.53
Dipole, Da:	7.82
IP(EA), eV:	-9.42(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[4-[(2,6-dimethylmorpholin-4-yl)methyl]benzoyl]-3,3-dimethylpiperazin-2-one

Drug info:

PubChemData

Smile

CC1=C(C(=O)N=C(N1)N2CCOCC2)CCC(=O)N3CCNC(=O)C3(C)C

DOS

IR

Vibrations