Geometry & MOs

Info

ID:	305747
PubChem CID:	124967535
Reduced:	O3N5C13H15 (1)
Stoich.:	A3B5C13D15 (1)
Weight, g/mol:	266.13789
ΔH_f, kcal/mol:	-49.85
Dipole, Da:	5.16
IP(EA), eV:	-9.42(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-N,2-dimethyl-4-(2-pyrazol-1-ylacetyl)morpholine-2-carboxamide

Drug info:

PubChemData

Smile

CC1=CN=C(N1)[C@@H]2COCCN2C(=O)C3=NNC(=O)C=C3

DOS

IR

Vibrations