Geometry & MOs

Info

ID:	262121
PubChem CID:	103271630
Reduced:	NOC14H29 (1)
Stoich.:	ABC14D29 (1)
Weight, g/mol:	280.178693
ΔH_f, kcal/mol:	-87.61
Dipole, Da:	2.52
IP(EA), eV:	-8.73(2.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-ethoxy-3-methyl-N-[1-(3-nitrophenyl)ethyl]butan-2-amine

Drug info:

PubChemData

Smile

CCOCC(C(C)C)NC1CCCCCC1

DOS

IR

Vibrations