Geometry & MOs

Info

ID:	367353
PubChem CID:	127324305
Reduced:	ON3C9H16 (2)
Stoich.:	AB3C9D16 (2)
Weight, g/mol:	311.232125
ΔH_f, kcal/mol:	-62.13
Dipole, Da:	1.92
IP(EA), eV:	-8.62(0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-N-[(1,4-dimethylpiperazin-2-yl)methyl]-3-N-methylpiperidine-1,3-dicarboxamide

Drug info:

PubChemData

Smile

CC1=C(OC(=N1)CN2CCN(CC2)C(=O)NCC3CN(CCN3C)C)C

DOS

IR

Vibrations