Geometry & MOs

Info

ID:	265777
PubChem CID:	103545191
Reduced:	SN3O4C11H17 (1)
Stoich.:	AB3C4D11E17 (1)
Weight, g/mol:	254.174276
ΔH_f, kcal/mol:	-150.71
Dipole, Da:	5.2
IP(EA), eV:	-9.05(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 5-amino-1-[2-(dimethylamino)propyl]-2-ethylimidazole-4-carboxylate

Drug info:

PubChemData

Smile

CC1=NC(=C(N1C2(CCS(=O)(=O)C2)C)N)C(=O)OC

DOS

IR

Vibrations