Geometry & MOs

Info

ID:	307619
PubChem CID:	125307777
Reduced:	S2N4O5C14H16 (1)
Stoich.:	A2B4C5D14E16 (1)
Weight, g/mol:	349.142641
ΔH_f, kcal/mol:	-145.7
Dipole, Da:	6.37
IP(EA), eV:	-9.67(-1.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-methoxy-N-[(Z)-(4-prop-2-enoxyphenyl)methylideneamino]-3H-indole-2-carboxamide

Drug info:

PubChemData

Smile

C[C@@H](C(=O)NC1=CC=C(C=C1)S(=O)(=O)N)SC2=NC(=O)CC(=N2)OC

DOS

IR

Vibrations