Geometry & MOs

Info

ID:	351391
PubChem CID:	127280279
Reduced:	SN3O4C16H27 (1)
Stoich.:	AB3C4D16E27 (1)
Weight, g/mol:	370.24811
ΔH_f, kcal/mol:	-185.67
Dipole, Da:	10.34
IP(EA), eV:	-9.46(0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1-(4,6-dimethylpyrimidin-2-yl)-3,5-dimethylpyrazol-4-yl]-N-methyl-N-(2-pyrrolidin-1-ylethyl)acetamide

Drug info:

PubChemData

Smile

CN(CCN1CCCC1)C(=O)C2CC(=O)N(C2)C3CCS(=O)(=O)C3

DOS

IR

Vibrations