Geometry & MOs

Info

ID:	44902
PubChem CID:	10506457
Reduced:	N3O5H27C32 (1)
Stoich.:	A3B5C27D32 (1)
Weight, g/mol:	533.280729
ΔH_f, kcal/mol:	-115.01
Dipole, Da:	7.76
IP(EA), eV:	-9.29(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(5-phenylmethoxy-1H-indol-3-yl)-4-[(tributyl-lambda5-phosphanylidene)amino]pyrrole-2,5-dione

Drug info:

PubChemData

Smile

CC1=CC=CC=C1C2=CC=CC=C2C(=O)NC3=CC=C(C=C3)C(=O)N4CCC(=O)N(C5=CC=CC=C54)CC(=O)O

DOS

IR

Vibrations