Geometry & MOs

Info

ID:	285525
PubChem CID:	104110019
Reduced:	NCl3C12H16 (1)
Stoich.:	AB3C12D16 (1)
Weight, g/mol:	189.128427
ΔH_f, kcal/mol:	-31.62
Dipole, Da:	1.21
IP(EA), eV:	-9.23(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-N-(cyclobutylmethyl)pentan-2-amine

Drug info:

PubChemData

Smile

CC(CC(C)Cl)NCC1=C(C=CC(=C1)Cl)Cl

DOS

IR

Vibrations