Geometry & MOs

Info

ID:	256292
PubChem CID:	103138252
Reduced:	ClNOC18H26 (1)
Stoich.:	ABCD18E26 (1)
Weight, g/mol:	325.10413
ΔH_f, kcal/mol:	-42.42
Dipole, Da:	4.26
IP(EA), eV:	-9.09(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(4-bromophenyl)methyl]-N-methyl-3-(5-methyloxolan-2-yl)propan-1-amine

Drug info:

PubChemData

Smile

CC1CCC(O1)CC(CC2=CC=C(C=C2)Cl)CNC3CC3

DOS

IR

Vibrations