Geometry & MOs

Info

ID:	425993
PubChem CID:	135134503
Reduced:	O2N5C26H29 (1)
Stoich.:	A2B5C26D29 (1)
Weight, g/mol:	402.205576
ΔH_f, kcal/mol:	6.96
Dipole, Da:	2.41
IP(EA), eV:	-8.59(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[C-[(Z)-2-aminoethenyl]-N-phenylcarbonimidoyl]-7-pyrrolidin-3-yloxyspiro[1H-indole-3,1'-cyclobutane]-2-one

Drug info:

PubChemData

Smile

CN1CCC(CC1)OC2=CC(=CC3=C2NC(=O)C34CCCC4)C5=NC=NN5C6=CC=CC=C6

DOS

IR

Vibrations