Geometry & MOs

Info

ID:	285523
PubChem CID:	104110016
Reduced:	ClNOC10H22 (1)
Stoich.:	ABCD10E22 (1)
Weight, g/mol:	241.123342
ΔH_f, kcal/mol:	-96.26
Dipole, Da:	4.45
IP(EA), eV:	-8.99(0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-N-[(2-methoxyphenyl)methyl]pentan-2-amine

Drug info:

PubChemData

Smile

CC(C)OCCNC(C)CC(C)Cl

DOS

IR

Vibrations