Geometry & MOs

Info

ID:	200518
PubChem CID:	79404383
Reduced:	O2N3C11H25 (1)
Stoich.:	A2B3C11D25 (1)
Weight, g/mol:	216.151415
ΔH_f, kcal/mol:	-110.21
Dipole, Da:	4.52
IP(EA), eV:	-8.78(1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,3-dihydro-1H-inden-5-yl)hexan-2-one

Drug info:

PubChemData

Smile

CCN(CC(C)(C)O)C(C)C(C)C(=O)NN

DOS

IR

Vibrations