Geometry & MOs

Info

ID:	313546
PubChem CID:	126615750
Reduced:	NF2O4H29C32 (1)
Stoich.:	AB2C4D29E32 (1)
Weight, g/mol:	291.121906
ΔH_f, kcal/mol:	-192.7
Dipole, Da:	7.79
IP(EA), eV:	-8.91(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (3R)-3-(furan-2-carbonylamino)-4-imidazol-1-yl-2-methylbutanoate

Drug info:

PubChemData

Smile

CC1=C(C(=C(C(=N1)C)C2=CC=C(C=C2)OCCC3=CC=C(C=C3)F)C4=CC5=C(C(=C4)F)OCCC5)CC(=O)O

DOS

IR

Vibrations