Geometry & MOs

Info

ID:	197449
PubChem CID:	78966734
Reduced:	NOC7H12 (2)
Stoich.:	ABC7D12 (2)
Weight, g/mol:	284.129156
ΔH_f, kcal/mol:	-69.44
Dipole, Da:	3.64
IP(EA), eV:	-8.71(0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2-chloro-5-nitrophenyl)methyl]-2,3,3-trimethylbutan-1-amine

Drug info:

PubChemData

Smile

CN(C)CCCNCC(C1=CC(=CC=C1)OC)O

DOS

IR

Vibrations