Geometry & MOs

Info

ID:	245396
PubChem CID:	99444281
Reduced:	N3O4C19H29 (1)
Stoich.:	A3B4C19D29 (1)
Weight, g/mol:	354.194343
ΔH_f, kcal/mol:	-197.67
Dipole, Da:	3.14
IP(EA), eV:	-9.08(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-(4-methoxynaphthalene-1-carbonyl)piperazin-1-yl]-2,2-dimethylpropan-1-one

Drug info:

PubChemData

Smile

CC(C)(C)C(=O)N1CCN(CC1)C(=O)CN2C(=O)[C@@H]3CCCC[C@H]3C2=O

DOS

IR

Vibrations