Geometry & MOs

Info

ID:	246064
PubChem CID:	103041082
Reduced:	ClFNC16H25 (1)
Stoich.:	ABCD16E25 (1)
Weight, g/mol:	297.12957
ΔH_f, kcal/mol:	-79.97
Dipole, Da:	4.29
IP(EA), eV:	-8.89(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[4-[(3-chloro-4-fluorophenyl)methyl]oxan-4-yl]methyl]cyclopropanamine

Drug info:

PubChemData

Smile

CCC(C)(CC1=CC(=C(C=C1)F)Cl)CNC(C)(C)C

DOS

IR

Vibrations