Geometry & MOs

Info

ID:	189075
PubChem CID:	77812080
Reduced:	NO5C30H35 (1)
Stoich.:	AB5C30D35 (1)
Weight, g/mol:	357.230394
ΔH_f, kcal/mol:	-186.09
Dipole, Da:	6.39
IP(EA), eV:	-8.99(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 13-phenyl-1-oxa-12-azaspiro[4.8]tridec-3-ene-12-carboxylate

Drug info:

PubChemData

Smile

CC1CCC2C(C(=O)C(CC23C1(CC4=C(O3)C5=C(C=C4)C(=O)NC5C6=CC=CC=C6OC)C)O)(C)C

DOS

IR

Vibrations