Geometry & MOs

Info

ID:	416038
PubChem CID:	135089043
Reduced:	N2C7H10 (3)
Stoich.:	A2B7C10 (3)
Weight, g/mol:	347.177982
ΔH_f, kcal/mol:	42.44
Dipole, Da:	2.82
IP(EA), eV:	-8.27(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[methyl-[2-(2-methylimidazol-1-yl)ethyl]amino]-N-(6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)acetamide

Drug info:

PubChemData

Smile

CC1=C(N=C(N=C1NC2CCN(CC2)CC3=CN=CC=C3)N4CCCC4)C

DOS

IR

Vibrations