Geometry & MOs

Info

ID:	419477
PubChem CID:	135108260
Reduced:	N3O6C16H17 (1)
Stoich.:	A3B6C16D17 (1)
Weight, g/mol:	363.159434
ΔH_f, kcal/mol:	-203.3
Dipole, Da:	2.53
IP(EA), eV:	-9.55(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[(1R,2R)-2-(dimethylamino)cyclopentyl]amino]-5-(4-fluoro-3-methoxyphenyl)-1,2-oxazole-4-carboxylic acid

Drug info:

PubChemData

Smile

C1[C@]2([C@@]1(CN(C2)CC(=O)NC3=CC=C(C=C3)C(=O)N)C(=O)O)C(=O)O

DOS

IR

Vibrations