Geometry & MOs

Info

ID:	217160
PubChem CID:	85087352
Reduced:	NO2C21H39 (1)
Stoich.:	AB2C21D39 (1)
Weight, g/mol:	337.108086
ΔH_f, kcal/mol:	-161.85
Dipole, Da:	2.94
IP(EA), eV:	-9.3(0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 8-(chloromethyl)-4-hydroxy-1-methyl-7,8-dihydrofuro[3,2-e]indole-6-carboxylate

Drug info:

PubChemData

Smile

CCCCCCCCCC=CC1CCCCN1C(=O)OC(C)(C)C

DOS

IR

Vibrations