Geometry & MOs

Info

ID:	257370
PubChem CID:	103145597
Reduced:	N2O3C15H18 (1)
Stoich.:	A2B3C15D18 (1)
Weight, g/mol:	274.131742
ΔH_f, kcal/mol:	-24.29
Dipole, Da:	5.21
IP(EA), eV:	-9.18(-1.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[5-(2,5-dimethyl-4-nitrophenyl)furan-2-yl]-N-methylethanamine

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1[N+](=O)[O-])C)C2=CC=C(O2)CC(C)N

DOS

IR

Vibrations