Geometry & MOs

Info

ID:	261042
PubChem CID:	103215384
Reduced:	ClINC15H21 (1)
Stoich.:	ABCD15E21 (1)
Weight, g/mol:	377.04072
ΔH_f, kcal/mol:	-0.08
Dipole, Da:	1.73
IP(EA), eV:	-9.4(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(3-chloro-4-iodophenyl)-2-cyclobutylethyl]propan-1-amine

Drug info:

PubChemData

Smile

CCC1CCCCC1C(C2=CC(=C(C=C2)I)Cl)N

DOS

IR

Vibrations