Geometry & MOs

Info

ID:	363371
PubChem CID:	127310908
Reduced:	OSN6C19H28 (1)
Stoich.:	ABC6D19E28 (1)
Weight, g/mol:	316.099397
ΔH_f, kcal/mol:	26.21
Dipole, Da:	3.71
IP(EA), eV:	-8.35(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-cyclopropylpyrimidin-4-yl)-[2-(1,3-thiazol-2-yl)morpholin-4-yl]methanone

Drug info:

PubChemData

Smile

CN1CCN(CC1)CC2CCN(CC2)C(=O)C3=CN=C(S3)C4=CN(N=C4)C

DOS

IR

Vibrations