Geometry & MOs

Info

ID:	447650
PubChem CID:	135284466
Reduced:	ClO2N3C15H22 (1)
Stoich.:	AB2C3D15E22 (1)
Weight, g/mol:	357.196489
ΔH_f, kcal/mol:	-103.98
Dipole, Da:	2.53
IP(EA), eV:	-9.04(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-[4-[(2S)-2-amino-2,4-dimethylpentoxy]-2-fluorophenyl]pyrazolo[1,5-a]pyrimidin-5-amine

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N1CCC(CC1)NC2=NC=CC(=C2)Cl

DOS

IR

Vibrations