Geometry & MOs

Info

ID:	333211
PubChem CID:	127251759
Reduced:	ON2C5H6 (3)
Stoich.:	AB2C5D6 (3)
Weight, g/mol:	312.169859
ΔH_f, kcal/mol:	-29.66
Dipole, Da:	3.01
IP(EA), eV:	-9.2(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[4-(cyclopropylmethyl)morpholin-2-yl]-N-pyrimidin-2-ylpyrazin-2-amine

Drug info:

PubChemData

Smile

COCC(=O)N1CCOC(C1)C2=CN=CC(=N2)NC3=NC=CC=N3

DOS

IR

Vibrations