Geometry & MOs

Info

ID:	270054
PubChem CID:	103624173
Reduced:	NOC9H17 (2)
Stoich.:	ABC9D17 (2)
Weight, g/mol:	306.205576
ΔH_f, kcal/mol:	-150.73
Dipole, Da:	2.03
IP(EA), eV:	-8.83(1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 3-(1H-pyrazol-5-ylmethylamino)-8-azabicyclo[3.2.1]octane-8-carboxylate

Drug info:

PubChemData

Smile

CC(C)CC(C)NC1CC2CCC(C1)N2C(=O)OC(C)(C)C

DOS

IR

Vibrations