Geometry & MOs

Info

ID:	226265
PubChem CID:	87350263
Reduced:	O5C9H14 (1)
Stoich.:	A5B9C14 (1)
Weight, g/mol:	256.107259
ΔH_f, kcal/mol:	-231.41
Dipole, Da:	6.03
IP(EA), eV:	-10.48(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5E)-5-indol-2-ylidene-N,N-dimethyl-2H-tetrazole-1-carboxamide

Drug info:

PubChemData

Smile

CCC(=O)CCC(C)(C(=O)O)C(=O)O

DOS

IR

Vibrations