Geometry & MOs

Info

ID:	285098
PubChem CID:	104097887
Reduced:	N2O4C15H18 (1)
Stoich.:	A2B4C15D18 (1)
Weight, g/mol:	274.077599
ΔH_f, kcal/mol:	-41.83
Dipole, Da:	6.71
IP(EA), eV:	-9.08(-1.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

COC(=O)C1=CC(=C(C=C1)[N+](=O)[O-])NCC2(CC2)C3CC3

DOS

IR

Vibrations