Geometry & MOs

Info

ID:	323540
PubChem CID:	126675345
Reduced:	N3O6C22H27 (1)
Stoich.:	A3B6C22D27 (1)
Weight, g/mol:	464.224597
ΔH_f, kcal/mol:	-195.69
Dipole, Da:	3.27
IP(EA), eV:	-9.28(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-[(5,6-diphenylpyrazin-2-yl)-propan-2-ylamino]butoxy]-N-methylsulfanylacetamide

Drug info:

PubChemData

Smile

CCO[C@H]1C[C@@H]1NC(=O)C2=CN(C(=O)C(=C2)C(=O)NC)CC3=CC(=CC=C3)OCCO

DOS

IR

Vibrations