Geometry & MOs

Info

ID:	421266
PubChem CID:	135115667
Reduced:	ON5C25H29 (1)
Stoich.:	AB5C25D29 (1)
Weight, g/mol:	317.156184
ΔH_f, kcal/mol:	28.29
Dipole, Da:	4.57
IP(EA), eV:	-9.17(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[methyl-[1-(3-methylpyridin-2-yl)propan-2-yl]amino]-N-(thiophen-2-ylmethyl)acetamide

Drug info:

PubChemData

Smile

CC1=CC(=NN1CC2=CC=C(C=C2)C(=O)N3CCCC4(C3)CCC5=CN=C(N=C45)C)C

DOS

IR

Vibrations