Geometry & MOs

Info

ID:	362196
PubChem CID:	127307209
Reduced:	N2O4C17H22 (1)
Stoich.:	A2B4C17D22 (1)
Weight, g/mol:	380.188212
ΔH_f, kcal/mol:	-63.68
Dipole, Da:	4.25
IP(EA), eV:	-8.73(0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[(2,6-dimethylmorpholin-4-yl)methyl]-1,3-thiazol-2-yl]-3-hydroxy-8-azabicyclo[3.2.1]octane-8-carboxamide

Drug info:

PubChemData

Smile

C1CC2CC(CC1N2C(=O)NCC3COC4=CC=CC=C4O3)O

DOS

IR

Vibrations