Geometry & MOs

Info

ID:	243302
PubChem CID:	99218254
Reduced:	O3N4C24H26 (1)
Stoich.:	A3B4C24D26 (1)
Weight, g/mol:	382.189257
ΔH_f, kcal/mol:	-50.18
Dipole, Da:	6.16
IP(EA), eV:	-8.97(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2-nitrophenoxy)-N-propyl-N-[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]propanamide

Drug info:

PubChemData

Smile

C1CN(CCC1OC2=CC=CC=C2)C(=O)C3=CC(=CC=C3)NC(=O)CCN4C=CN=C4

DOS

IR

Vibrations