Geometry & MOs

Info

ID:	349197
PubChem CID:	127274923
Reduced:	N3O3C22H31 (1)
Stoich.:	A3B3C22D31 (1)
Weight, g/mol:	350.174276
ΔH_f, kcal/mol:	-120.64
Dipole, Da:	5.28
IP(EA), eV:	-9.09(0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)-(5-methyl-2-phenylmorpholin-4-yl)methanone

Drug info:

PubChemData

Smile

CC1COC(CN1C(=O)C2CCCN(C2)C(=O)N3CCCC3)C4=CC=CC=C4

DOS

IR

Vibrations