Geometry & MOs

Info

ID:	234993
PubChem CID:	92303850
Reduced:	SF2N2O2H18C20 (1)
Stoich.:	AB2C2D2E18F20 (1)
Weight, g/mol:	359.173273
ΔH_f, kcal/mol:	-120.18
Dipole, Da:	7.41
IP(EA), eV:	-9.0(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 1-ethyl-4-[(2R)-2-(2-methoxyphenoxy)propanoyl]-3,5-dimethylpyrrole-2-carboxylate

Drug info:

PubChemData

Smile

C1CC(C1)C(=O)NC2=CC=CC=C2[C@H]3N(C(=O)CS3)C4=C(C=C(C=C4)F)F

DOS

IR

Vibrations