Geometry & MOs

Info

ID:	341416
PubChem CID:	127264109
Reduced:	O5C16H18 (1)
Stoich.:	A5B16C18 (1)
Weight, g/mol:	287.115758
ΔH_f, kcal/mol:	-187.73
Dipole, Da:	5.71
IP(EA), eV:	-9.36(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 7-propan-2-yloxy-4,5-dihydrobenzo[g][1,2]benzoxazole-3-carboxylate

Drug info:

PubChemData

Smile

CC(C)OC1=CC2=C(C=C1)C(=O)C(CC2)C(=O)C(=O)OC

DOS

IR

Vibrations