Geometry & MOs

Info

ID:	415407
PubChem CID:	135088401
Reduced:	N3O4C15H17 (1)
Stoich.:	A3B4C15D17 (1)
Weight, g/mol:	323.114903
ΔH_f, kcal/mol:	-92.0
Dipole, Da:	6.8
IP(EA), eV:	-9.69(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S,4R)-1-(2-amino-5-chloro-6-methylpyrimidin-4-yl)-4-[(3-methyl-1,2-oxazol-5-yl)methyl]pyrrolidin-3-ol

Drug info:

PubChemData

Smile

CC1=NOC(=C1)C[C@@H]2CN(C[C@H]2O)C3=C(C=CC=N3)C(=O)O

DOS

IR

Vibrations