Geometry & MOs

Info

ID:	74408
PubChem CID:	48421828
Reduced:	N3O4C19H27 (1)
Stoich.:	A3B4C19D27 (1)
Weight, g/mol:	282.194343
ΔH_f, kcal/mol:	-167.42
Dipole, Da:	2.21
IP(EA), eV:	-9.32(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-[2-(cyclopropylmethoxy)propanoyl]piperazin-1-yl]-2-methylpropan-1-one

Drug info:

PubChemData

Smile

CC(C)C(=O)N1CCN(CC1)C(=O)C(CC2=CC=CC=C2)NC(=O)OC

DOS

IR

Vibrations