Geometry & MOs

Info

ID:	163942
PubChem CID:	74381017
Reduced:	SO6C21H26 (1)
Stoich.:	AB6C21D26 (1)
Weight, g/mol:	397.178376
ΔH_f, kcal/mol:	-246.22
Dipole, Da:	3.4
IP(EA), eV:	-8.65(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methanesulfonic acid;1-[(5-methoxyindol-3-ylidene)methylamino]-2-pentylguanidine

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1CC2=CC=C(C=C2)OC)C3C(C(C(C(S3)CO)O)O)O)O

DOS

IR

Vibrations