Geometry & MOs

Info

ID:	287310
PubChem CID:	104234356
Reduced:	FN2O2C15H19 (1)
Stoich.:	AB2C2D15E19 (1)
Weight, g/mol:	299.124547
ΔH_f, kcal/mol:	-70.8
Dipole, Da:	4.28
IP(EA), eV:	-9.04(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-[[1-(difluoromethyl)imidazol-2-yl]methoxy]-3-fluorophenyl]-N-methylethanamine

Drug info:

PubChemData

Smile

CC(C1=CC(=C(C=C1)OC(C)C(=O)NCC#C)F)NC

DOS

IR

Vibrations