Geometry & MOs

Info

ID:	368045
PubChem CID:	127326815
Reduced:	O2N4C17H32 (1)
Stoich.:	A2B4C17D32 (1)
Weight, g/mol:	335.232125
ΔH_f, kcal/mol:	-117.29
Dipole, Da:	4.24
IP(EA), eV:	-8.64(1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(oxan-3-yl)-4-[(1,3,5-trimethylpyrazol-4-yl)methyl]piperazine-1-carboxamide

Drug info:

PubChemData

Smile

CC(=O)N1CCC(CC1)CNC(=O)N(C)CC2CCCN(C2)C

DOS

IR

Vibrations