Geometry & MOs

Info

ID:	345784
PubChem CID:	127270084
Reduced:	NOC8H14 (2)
Stoich.:	ABC8D14 (2)
Weight, g/mol:	247.168462
ΔH_f, kcal/mol:	-126.07
Dipole, Da:	5.2
IP(EA), eV:	-9.37(1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

cycloheptyl(1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl)methanone

Drug info:

PubChemData

Smile

CC(=O)N(C)C1CCN(CC1)C(=O)C2CCCCCC2

DOS

IR

Vibrations