Geometry & MOs

Info

ID:	217957
PubChem CID:	85088653
Reduced:	FNO5C23H26 (1)
Stoich.:	ABC5D23E26 (1)
Weight, g/mol:	415.131425
ΔH_f, kcal/mol:	-215.2
Dipole, Da:	4.41
IP(EA), eV:	-8.25(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1-[1-(3,4-dimethoxyphenyl)sulfonylindol-3-yl]ethylideneamino]guanidine

Drug info:

PubChemData

Smile

CC1(OCC(O1)C2C(C(=O)N2C3=CC=C(C=C3)OC)(C(C)(C4=CC=CC=C4)O)F)C

DOS

IR

Vibrations