Geometry & MOs

Info

ID:	330320
PubChem CID:	127247307
Reduced:	O2N5C15H19 (1)
Stoich.:	A2B5C15D19 (1)
Weight, g/mol:	301.19026
ΔH_f, kcal/mol:	-26.31
Dipole, Da:	1.75
IP(EA), eV:	-9.28(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations