Geometry & MOs

Info

ID:	275712
PubChem CID:	103817217
Reduced:	ClOF3N3C11H13 (1)
Stoich.:	ABC3D3E11F13 (1)
Weight, g/mol:	251.126991
ΔH_f, kcal/mol:	-175.01
Dipole, Da:	3.88
IP(EA), eV:	-10.13(-1.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-[cyclopropyl-(1-methylimidazole-4-carbonyl)amino]acetate

Drug info:

PubChemData

Smile

CCCCN(CC(F)(F)F)C(=O)C1=CN=C(C=N1)Cl

DOS

IR

Vibrations