Geometry & MOs

Info

ID:	362943
PubChem CID:	127309949
Reduced:	O2N4C19H24 (1)
Stoich.:	A2B4C19D24 (1)
Weight, g/mol:	300.183778
ΔH_f, kcal/mol:	-27.52
Dipole, Da:	6.06
IP(EA), eV:	-9.36(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-hydroxy-N-(2-methyl-2,3-dihydro-1H-inden-1-yl)-8-azabicyclo[3.2.1]octane-8-carboxamide

Drug info:

PubChemData

Smile

CC1CC2=CC=CC=C2C1NC(=O)N3CCOC(C3)CN4C=CC=N4

DOS

IR

Vibrations