Geometry & MOs

Info

ID:	285103
PubChem CID:	104098154
Reduced:	SN2O2C10H14 (1)
Stoich.:	AB2C2D10E14 (1)
Weight, g/mol:	226.077599
ΔH_f, kcal/mol:	23.77
Dipole, Da:	6.5
IP(EA), eV:	-9.6(-1.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-ethyl-N-[(5-nitrothiophen-2-yl)methyl]cyclopropan-1-amine

Drug info:

PubChemData

Smile

C/C=C/CCNCC1=CC=C(S1)[N+](=O)[O-]

DOS

IR

Vibrations