Geometry & MOs

Info

ID:	429397
PubChem CID:	135169420
Reduced:	NC19H31 (1)
Stoich.:	AB19C31 (1)
Weight, g/mol:	366.100442
ΔH_f, kcal/mol:	-24.36
Dipole, Da:	1.18
IP(EA), eV:	-8.42(0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(2-nitronaphthalen-1-yl)-2-phenyl-1,3-benzoxazole

Drug info:

PubChemData

Smile

CCN(CCC1=CC=C(C=C1)C2CCCC2)CC(C)C

DOS

IR

Vibrations