Geometry & MOs

Info

ID:	395079
PubChem CID:	135024614
Reduced:	NOC9H13 (2)
Stoich.:	ABC9D13 (2)
Weight, g/mol:	378.219495
ΔH_f, kcal/mol:	-27.84
Dipole, Da:	1.35
IP(EA), eV:	-8.94(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[2-[(4-ethenylphenyl)methoxymethyl]-2,3-dihydro-1H-inden-5-yl]methoxymethyl]-3-methyloxetane

Drug info:

PubChemData

Smile

C[C@@]1([C@H](N(O1)C(C)(C)C)C2=CC=CC=C2)C3=NC(CO3)(C)C

DOS

IR

Vibrations