Geometry & MOs

Info

ID:	181395
PubChem CID:	76742533
Reduced:	OC7H13 (2)
Stoich.:	AB7C13 (2)
Weight, g/mol:	681.370176
ΔH_f, kcal/mol:	-134.26
Dipole, Da:	1.91
IP(EA), eV:	-10.07(1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

cyclopentyl 3-[5-[2-[1-(cyclopropylmethylcarbamoyl)-2-(2,2-difluoroethyl)cyclopropyl]acetyl]-3-(4-pyrazol-1-ylphenyl)imidazolidine-1-carbonyl]-4,4-dimethylpentanoate

Drug info:

PubChemData

Smile

CC(CCCCCC=C)C(=O)OC(C)(C)C

DOS

IR

Vibrations