Geometry & MOs

Info

ID:	349996
PubChem CID:	127276869
Reduced:	O2N4C15H28 (1)
Stoich.:	A2B4C15D28 (1)
Weight, g/mol:	288.150764
ΔH_f, kcal/mol:	-111.63
Dipole, Da:	9.74
IP(EA), eV:	-9.06(0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1,1-dioxothiolan-3-yl)-(4-propan-2-yl-1,4-diazepan-1-yl)methanone

Drug info:

PubChemData

Smile

CC(C)N1CCCN(CC1)C(=O)C2CCCN(C2)C(=O)N

DOS

IR

Vibrations