Geometry & MOs

Info

ID:	275615
PubChem CID:	103816775
Reduced:	NSO2C15H15 (1)
Stoich.:	ABC2D15E15 (1)
Weight, g/mol:	235.120843
ΔH_f, kcal/mol:	-47.56
Dipole, Da:	1.81
IP(EA), eV:	-9.19(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-ethoxy-N-[(1S,2R)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]acetamide

Drug info:

PubChemData

Smile

CC1=C(SC=C1)C(=O)N[C@@H]2[C@@H](CC3=CC=CC=C23)O

DOS

IR

Vibrations