Geometry & MOs

Info

ID:	246219
PubChem CID:	103050080
Reduced:	ClFINC9H10 (1)
Stoich.:	ABCDE9F10 (1)
Weight, g/mol:	275.064383
ΔH_f, kcal/mol:	-21.87
Dipole, Da:	1.58
IP(EA), eV:	-9.55(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[1-(2-chloroethyl)cyclopropyl]methyl]-1-(5-chloro-2-fluorophenyl)methanamine

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1Cl)CNCCI)F

DOS

IR

Vibrations