Geometry & MOs

Info

ID:	267113
PubChem CID:	103580846
Reduced:	NOC8H10 (2)
Stoich.:	ABC8D10 (2)
Weight, g/mol:	296.09277
ΔH_f, kcal/mol:	-14.93
Dipole, Da:	7.42
IP(EA), eV:	-9.35(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4-chloro-2-nitrophenyl)methyl]-2-cyclopropyloxolan-3-amine

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)C#N)CNC2CCOC2C3CC3

DOS

IR

Vibrations