Geometry & MOs

Info

ID:	169336
PubChem CID:	75090061
Reduced:	N2O7C19H24 (1)
Stoich.:	A2B7C19D24 (1)
Weight, g/mol:	366.106316
ΔH_f, kcal/mol:	-275.16
Dipole, Da:	4.56
IP(EA), eV:	-8.67(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,3,4,7-tetrahydroxy-6-oxo-2,3,4,4a,5,11b-hexahydro-1H-[1,3]dioxolo[4,5-j]phenanthridin-1-yl)acetamide

Drug info:

PubChemData

Smile

C1CCN(CC1)C2C3C(C(C(C2O)O)O)NC(=O)C4=C(C5=C(C=C34)OCO5)O

DOS

IR

Vibrations