Geometry & MOs

Info

ID:	330362
PubChem CID:	127247349
Reduced:	O3N5C16H23 (1)
Stoich.:	A3B5C16D23 (1)
Weight, g/mol:	336.169859
ΔH_f, kcal/mol:	-110.88
Dipole, Da:	5.69
IP(EA), eV:	-9.14(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(4-methyl-1H-pyrazol-5-yl)piperidin-1-yl]-(3-pyridin-3-yl-1H-pyrazol-5-yl)methanone

Drug info:

PubChemData

Smile

CC1=C(NN=C1)C2CCCCN2C(=O)CN3C(=O)C(NC3=O)(C)C

DOS

IR

Vibrations