Geometry & MOs

Info

ID:	195097
PubChem CID:	78634662
Reduced:	FN2O4C18H19 (1)
Stoich.:	AB2C4D18E19 (1)
Weight, g/mol:	381.158766
ΔH_f, kcal/mol:	-131.61
Dipole, Da:	9.74
IP(EA), eV:	-9.36(-1.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[[2-[3-(3-fluoro-4-methoxyphenyl)prop-2-enoyloxy]acetyl]amino]-4-methylpentanoate

Drug info:

PubChemData

Smile

CC(C#N)(C1CC1)NC(=O)COC(=O)C=CC2=CC(=C(C=C2)OC)F

DOS

IR

Vibrations