Geometry & MOs

Info

ID:	355580
PubChem CID:	127289338
Reduced:	ON7C18H23 (1)
Stoich.:	AB7C18D23 (1)
Weight, g/mol:	370.24811
ΔH_f, kcal/mol:	50.82
Dipole, Da:	7.39
IP(EA), eV:	-9.07(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-cyclohexyl-1-methylpyrazol-4-yl)-[4-[(1-methylimidazol-2-yl)methyl]piperazin-1-yl]methanone

Drug info:

PubChemData

Smile

CC1=NC2=NNC(=C2C(=C1)C(=O)N3CCN(CC3)CC4=NC=CN4C)C

DOS

IR

Vibrations