Geometry & MOs

Info

ID:	233138
PubChem CID:	87692546
Reduced:	OCl2N3C23H25 (1)
Stoich.:	AB2C3D23E25 (1)
Weight, g/mol:	150.085621
ΔH_f, kcal/mol:	76.56
Dipole, Da:	4.25
IP(EA), eV:	-8.91(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,2-difluoroheptanal

Drug info:

PubChemData

Smile

C1CC(CC#C1)(CNC2=C(C=CN=C2)C(=O)NCC3CC3)C4=CC(=CC=C4)Cl.Cl

DOS

IR

Vibrations