Geometry & MOs

Info

ID:	292146
PubChem CID:	114465864
Reduced:	ClNSO2C15H18 (1)
Stoich.:	ABCD2E15F18 (1)
Weight, g/mol:	233.177964
ΔH_f, kcal/mol:	-14.86
Dipole, Da:	2.36
IP(EA), eV:	-9.29(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2-ethylphenyl)methyl]-2-(2-methylprop-2-enoxy)ethanamine

Drug info:

PubChemData

Smile

CC(=C)COCCNC(C1=CC=CO1)C2=CC=C(S2)Cl

DOS

IR

Vibrations