Geometry & MOs

Info

ID:	364659
PubChem CID:	127315954
Reduced:	N2O2C15H20 (1)
Stoich.:	A2B2C15D20 (1)
Weight, g/mol:	236.163711
ΔH_f, kcal/mol:	-55.17
Dipole, Da:	4.32
IP(EA), eV:	-8.78(0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2,4-dimethylpiperazin-1-yl)-(1,3-dimethylpyrazol-4-yl)methanone

Drug info:

PubChemData

Smile

CC1CN(CCN1C(=O)C2COC3=CC=CC=C23)C

DOS

IR

Vibrations