Geometry & MOs

Info

ID:	183165
PubChem CID:	76985234
Reduced:	N2O5C14H16 (1)
Stoich.:	A2B5C14D16 (1)
Weight, g/mol:	291.104148
ΔH_f, kcal/mol:	-128.74
Dipole, Da:	3.07
IP(EA), eV:	-9.15(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[5-[[methyl-[(1-methylimidazol-2-yl)methyl]amino]methyl]thiophen-3-yl]prop-2-enoic acid

Drug info:

PubChemData

Smile

C1COCCN1C(=O)COC2=CC3=C(C=C2)C(=NO)CO3

DOS

IR

Vibrations