Geometry & MOs

Info

ID:	183135
PubChem CID:	76982132
Reduced:	N3O3C12H23 (1)
Stoich.:	A3B3C12D23 (1)
Weight, g/mol:	253.123342
ΔH_f, kcal/mol:	-121.87
Dipole, Da:	2.75
IP(EA), eV:	-8.75(0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[4-(3-chloroprop-2-enoxy)phenyl]methyl]-2-methylpropan-1-amine

Drug info:

PubChemData

Smile

CCC(CC)(C(=NO)N)NC(=O)C1CCCOC1

DOS

IR

Vibrations