Geometry & MOs

Info

ID:	285114
PubChem CID:	104098252
Reduced:	N3C13H23 (1)
Stoich.:	A3B13C23 (1)
Weight, g/mol:	244.03402
ΔH_f, kcal/mol:	31.9
Dipole, Da:	1.82
IP(EA), eV:	-8.97(0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(5-nitrothiophen-2-yl)methyl]thiolan-3-amine

Drug info:

PubChemData

Smile

CC(C)CN1C=C(C=N1)CNCCC2CC2

DOS

IR

Vibrations