Geometry & MOs

Info

ID:	417734
PubChem CID:	135102624
Reduced:	NO6C16H17 (1)
Stoich.:	AB6C16D17 (1)
Weight, g/mol:	299.188529
ΔH_f, kcal/mol:	-209.37
Dipole, Da:	7.07
IP(EA), eV:	-9.67(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,3-dihydro-1H-inden-2-yl-[(4R,5S)-4-hydroxy-7-azaspiro[4.5]decan-7-yl]methanone

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)OC)C(=O)N2C[C@]3(C[C@]3(C2)C(=O)O)C(=O)O

DOS

IR

Vibrations