Geometry & MOs

Info

ID:	306172
PubChem CID:	125002168
Reduced:	O2N6C17H24 (1)
Stoich.:	A2B6C17D24 (1)
Weight, g/mol:	329.185175
ΔH_f, kcal/mol:	-31.84
Dipole, Da:	2.99
IP(EA), eV:	-8.96(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R)-2-[4-[(dimethylamino)methyl]pyrimidin-2-yl]pyrrolidin-1-yl]-(3,5-dimethyl-1,2-oxazol-4-yl)methanone

Drug info:

PubChemData

Smile

CCC1=NC=CN1CCC(=O)NC[C@]2(CCN(C2)C3=NC=CN=C3)O

DOS

IR

Vibrations