Geometry & MOs

Info

ID:	346426
PubChem CID:	127270930
Reduced:	ON2C11H15 (2)
Stoich.:	AB2C11D15 (2)
Weight, g/mol:	361.179027
ΔH_f, kcal/mol:	-62.54
Dipole, Da:	2.82
IP(EA), eV:	-9.01(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(5-methyl-1H-indazole-7-carbonyl)piperidin-4-yl]-(4-methylphenyl)methanone

Drug info:

PubChemData

Smile

CC1=CC2=C(C(=C1)C(=O)N3CCN(CC3)C(=O)CCC4CCCCC4)NN=C2

DOS

IR

Vibrations