Geometry & MOs

Info

ID:	59498
PubChem CID:	24875154
Reduced:	ON4C18H20 (1)
Stoich.:	AB4C18D20 (1)
Weight, g/mol:	369.18009
ΔH_f, kcal/mol:	60.36
Dipole, Da:	9.89
IP(EA), eV:	-8.9(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-acetamido-4-methyl-N-[(5-oxo-1H-pyrazolo[1,5-a]quinazolin-3-yl)methyl]pentanamide

Drug info:

PubChemData

Smile

C1CC1CN2CCC(C2)C3=CC4=NC(=O)C5=CC=CC=C5N4N3

DOS

IR

Vibrations