Geometry & MOs

Info

ID:	370808
PubChem CID:	127340623
Reduced:	ON5C23H35 (1)
Stoich.:	AB5C23D35 (1)
Weight, g/mol:	377.213698
ΔH_f, kcal/mol:	-15.07
Dipole, Da:	4.96
IP(EA), eV:	-8.66(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(4-cyclopentyl-1,4-diazepan-1-yl)-3-methyl-1-oxobutan-2-yl]thiophene-2-carboxamide

Drug info:

PubChemData

Smile

CC(C)C1=NC2=C(C=NN2C(C)C)C(=C1)C(=O)N3CCCN(CC3)C4CCCC4

DOS

IR

Vibrations