Geometry & MOs

Info

ID:	357657
PubChem CID:	127294331
Reduced:	N7C22H29 (1)
Stoich.:	A7B22C29 (1)
Weight, g/mol:	274.171499
ΔH_f, kcal/mol:	98.4
Dipole, Da:	4.03
IP(EA), eV:	-8.59(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(1,3,3-trimethyl-6-azabicyclo[3.2.1]octan-6-yl)ethyl]methanesulfonamide

Drug info:

PubChemData

Smile

CN1CCCCC1CN2CCN(CC2)C3=NC=NC4=C3C=NN4C5=CC=CC=C5

DOS

IR

Vibrations