Geometry & MOs

Info

ID:	68449
PubChem CID:	46508433
Reduced:	FOSN2H21C23 (1)
Stoich.:	ABCD2E21F23 (1)
Weight, g/mol:	493.158389
ΔH_f, kcal/mol:	2.71
Dipole, Da:	3.35
IP(EA), eV:	-8.38(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-[3-(5-fluoro-2-phenyl-1H-indol-3-yl)propanoyl]-2-morpholin-4-yl-1,3-thiazole-4-carbohydrazide

Drug info:

PubChemData

Smile

C1CN(CCN1C2=CC=CC=C2)C(=O)/C=C/C3=CC=C(S3)C4=CC=C(C=C4)F

DOS

IR

Vibrations