Geometry & MOs

Info

ID:	273535
PubChem CID:	103771322
Reduced:	NO3C17H25 (1)
Stoich.:	AB3C17D25 (1)
Weight, g/mol:	261.172879
ΔH_f, kcal/mol:	-127.32
Dipole, Da:	3.56
IP(EA), eV:	-8.79(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-hydroxy-4-methylpentyl)-2,3-dihydro-1H-indene-5-carboxamide

Drug info:

PubChemData

Smile

CCOC1=CC=C(C=C1)/C=C/C(=O)NCC(CC(C)C)O

DOS

IR

Vibrations