Geometry & MOs

Info

ID:	374473
PubChem CID:	131329883
Reduced:	N2O3C11H20 (1)
Stoich.:	A2B3C11D20 (1)
Weight, g/mol:	223.08087
ΔH_f, kcal/mol:	-115.97
Dipole, Da:	6.15
IP(EA), eV:	-9.05(0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-cyclopropyl-3-(3,6-difluoro-2-hydroxyphenyl)propanenitrile

Drug info:

PubChemData

Smile

CN(C)C(=O)COC1CCOC2(C1)CNC2

DOS

IR

Vibrations