Geometry & MOs

Info

ID:	126059
PubChem CID:	50950103
Reduced:	SN2O3C17H24 (1)
Stoich.:	AB2C3D17E24 (1)
Weight, g/mol:	362.149124
ΔH_f, kcal/mol:	-71.95
Dipole, Da:	7.59
IP(EA), eV:	-9.37(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[1-(3-methoxyphenyl)pyrazol-4-yl]methyl]-2-methylimidazo[1,2-a]pyrimidine-3-carboxamide

Drug info:

PubChemData

Smile

CC(C)CN(CC#CC1=CC=CC=C1)C(=O)CCNS(=O)(=O)C

DOS

IR

Vibrations