Geometry & MOs

Info

ID:	222282
PubChem CID:	85296169
Reduced:	NO4H17C18 (1)
Stoich.:	AB4C17D18 (1)
Weight, g/mol:	312.158626
ΔH_f, kcal/mol:	-40.84
Dipole, Da:	3.91
IP(EA), eV:	-9.57(-1.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-azido-1-(furan-2-ylmethyl)-4-(3,6,6-trimethyl-2-bicyclo[3.1.0]hex-2-enyl)azetidin-2-one

Drug info:

PubChemData

Smile

CCOC(=O)C(=CC1=CC=CC=C1[N+](=O)[O-])CC2=CC=CC=C2

DOS

IR

Vibrations