Geometry & MOs

Info

ID:	275602
PubChem CID:	103816752
Reduced:	O2N3C15H17 (1)
Stoich.:	A2B3C15D17 (1)
Weight, g/mol:	281.141579
ΔH_f, kcal/mol:	-36.22
Dipole, Da:	4.82
IP(EA), eV:	-9.37(0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1S,2R)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]-3,4-dimethylbenzamide

Drug info:

PubChemData

Smile

CC1=NN(C=C1C(=O)N[C@@H]2[C@@H](CC3=CC=CC=C23)O)C

DOS

IR

Vibrations