Geometry & MOs

Info

ID:	344376
PubChem CID:	127267552
Reduced:	N3O3C14H19 (1)
Stoich.:	A3B3C14D19 (1)
Weight, g/mol:	349.120861
ΔH_f, kcal/mol:	-131.13
Dipole, Da:	1.94
IP(EA), eV:	-8.38(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-N-[4-methyl-1-oxo-1-(1,3-thiazol-2-ylamino)pentan-2-yl]-6-oxopyrimidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=CC=C(C(=O)N1)NC(=O)C2CCCCN(C2=O)C

DOS

IR

Vibrations