Geometry & MOs

Info

ID:	342203
PubChem CID:	127264980
Reduced:	SCl2O2N5C17H17 (1)
Stoich.:	AB2C2D5E17F17 (1)
Weight, g/mol:	215.117095
ΔH_f, kcal/mol:	-12.1
Dipole, Da:	8.44
IP(EA), eV:	-8.4(-1.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[(Z)-(2-methylindol-3-ylidene)methyl]amino]guanidine

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)N=C2N=C(/C(=C/NNC(=O)CN3CCCC3=O)/S2)Cl)Cl

DOS

IR

Vibrations