Geometry & MOs

Info

ID:	333138
PubChem CID:	127251686
Reduced:	O2N6C25H26 (1)
Stoich.:	A2B6C25D26 (1)
Weight, g/mol:	387.22704
ΔH_f, kcal/mol:	23.77
Dipole, Da:	6.15
IP(EA), eV:	-8.58(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-1-[2-[2-methyl-3-(morpholin-4-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-yl]morpholin-4-yl]propan-1-one

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1)NN=C2C(=O)N3CCOC(C3)C4=NC(=CC(=C4)NC5=C(C=CC=N5)C)C

DOS

IR

Vibrations