Geometry & MOs

Info

ID:	345761
PubChem CID:	127270061
Reduced:	ON4C16H26 (1)
Stoich.:	AB4C16D26 (1)
Weight, g/mol:	275.199762
ΔH_f, kcal/mol:	-29.2
Dipole, Da:	5.5
IP(EA), eV:	-9.63(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)cycloheptanecarboxamide

Drug info:

PubChemData

Smile

CN1C=NN=C1C2CCN(CC2)C(=O)C3CCCCCC3

DOS

IR

Vibrations