Geometry & MOs

Info

ID:	216474
PubChem CID:	85086290
Reduced:	O2C19H22 (1)
Stoich.:	A2B19C22 (1)
Weight, g/mol:	272.116092
ΔH_f, kcal/mol:	-18.75
Dipole, Da:	5.47
IP(EA), eV:	-7.95(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-diazo-5-oxo-5-(2-prop-2-enylphenyl)pentanoate

Drug info:

PubChemData

Smile

C1CCC2C(C1)CCC3C2OC=C(C3=O)C4=CC=CC=C4

DOS

IR

Vibrations