Geometry & MOs

Info

ID:	254112
PubChem CID:	103122801
Reduced:	BrO2N3C12H18 (1)
Stoich.:	AB2C3D12E18 (1)
Weight, g/mol:	305.12949
ΔH_f, kcal/mol:	-50.55
Dipole, Da:	5.68
IP(EA), eV:	-9.29(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[1-(chloromethyl)cyclohexyl]methyl]pyrazolo[1,5-a]pyridine-3-carboxamide

Drug info:

PubChemData

Smile

CN1C=CC(=N1)C(=O)N2CCC(CC2)OCCBr

DOS

IR

Vibrations