Geometry & MOs

Info

ID:	315945
PubChem CID:	126629474
Reduced:	N2O5C23H32 (1)
Stoich.:	A2B5C23D32 (1)
Weight, g/mol:	492.153266
ΔH_f, kcal/mol:	-195.38
Dipole, Da:	6.05
IP(EA), eV:	-9.13(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-[(9,10-dioxoanthracen-2-yl)carbamoyl]-3-[2-(2-methylprop-2-enoyloxy)ethylamino]-3-oxopropanoate

Drug info:

PubChemData

Smile

CCCCN(C)C(=O)C(C(=O)CCCOC(=O)C(=C)C)C(=O)N(C)C1=CC=CC=C1

DOS

IR

Vibrations