Geometry & MOs

Info

ID:	380223
PubChem CID:	134970593
Reduced:	SN4C5H10 (1)
Stoich.:	AB4C5D10 (1)
Weight, g/mol:	232.127486
ΔH_f, kcal/mol:	95.86
Dipole, Da:	3.89
IP(EA), eV:	-8.67(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (E)-3-[(1R)-2,2-difluoro-3-pentylcyclopropyl]prop-2-enoate

Drug info:

PubChemData

Smile

CC1(N=N1)CNC(=S)NC

DOS

IR

Vibrations