Geometry & MOs

Info

ID:	246065
PubChem CID:	103041100
Reduced:	ClFNOC16H21 (1)
Stoich.:	ABCDE16F21 (1)
Weight, g/mol:	297.165956
ΔH_f, kcal/mol:	-72.21
Dipole, Da:	4.28
IP(EA), eV:	-9.24(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3-chloro-4-fluorophenyl)-2-cyclopropyl-2-methyl-N-(2-methylpropyl)propan-1-amine

Drug info:

PubChemData

Smile

C1CC1NCC2(CCOCC2)CC3=CC(=C(C=C3)F)Cl

DOS

IR

Vibrations