Geometry & MOs

Info

ID:	218476
PubChem CID:	85089505
Reduced:	O2C15H23 (2)
Stoich.:	A2B15C23 (2)
Weight, g/mol:	472.132924
ΔH_f, kcal/mol:	-169.93
Dipole, Da:	7.19
IP(EA), eV:	-8.06(0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2,3,4,5-tetraacetyloxy-5-(4-nitro-1H-pyrrol-3-yl)pentyl] acetate

Drug info:

PubChemData

Smile

CC1C2C3=CCC4C5(CCC(C(C5CC(C4(C3(CCC2(CCC1=C)C(=O)O)C)C)O)(C)C)O)C

DOS

IR

Vibrations