Geometry & MOs

Info

ID:	368707
PubChem CID:	127329916
Reduced:	ON5C20H33 (1)
Stoich.:	AB5C20D33 (1)
Weight, g/mol:	352.247441
ΔH_f, kcal/mol:	-34.21
Dipole, Da:	5.58
IP(EA), eV:	-8.41(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(cyclopropanecarbonyl)piperidin-4-yl]-4-(2-methoxyethyl)-3-methylpiperazine-1-carboxamide

Drug info:

PubChemData

Smile

CCC1CCCN(CC1)C(=O)NCC2=CN=C(C=C2)N3CCN(CC3)C

DOS

IR

Vibrations