Geometry & MOs

Info

ID:	320316
PubChem CID:	126659505
Reduced:	N2O3H20C21 (1)
Stoich.:	A2B3C20D21 (1)
Weight, g/mol:	404.246378
ΔH_f, kcal/mol:	-6.9
Dipole, Da:	2.62
IP(EA), eV:	-8.86(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[5-[4-[4-(1-ethylcyclopropyl)phenyl]phenyl]-3-methyl-1,2-oxazol-4-yl]amino]pentan-1-ol

Drug info:

PubChemData

Smile

CC1=NOC(=C1NC)C2=CC=C(C=C2)C3=CC=C(C=C3)C4(CC4)C(=O)O

DOS

IR

Vibrations