Geometry & MOs

Info

ID:	70595
PubChem CID:	48413571
Reduced:	O3N4C23H34 (1)
Stoich.:	A3B4C23D34 (1)
Weight, g/mol:	384.26376
ΔH_f, kcal/mol:	-102.91
Dipole, Da:	3.12
IP(EA), eV:	-8.71(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3-cyano-5,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)-N-[5-(diethylamino)pentan-2-yl]propanamide

Drug info:

PubChemData

Smile

CCN(CC)CCCC(C)NC(=O)C1=CC=C(C=C1)N2C(=C(C=N2)C(=O)OCC)C

DOS

IR

Vibrations