Geometry & MOs

Info

ID:	350003
PubChem CID:	127276876
Reduced:	ON2C15H28 (1)
Stoich.:	AB2C15D28 (1)
Weight, g/mol:	343.192963
ΔH_f, kcal/mol:	-78.73
Dipole, Da:	4.22
IP(EA), eV:	-8.81(1.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-morpholin-4-yl-2-oxoethyl)sulfanyl-1-(4-propan-2-yl-1,4-diazepan-1-yl)ethanone

Drug info:

PubChemData

Smile

CC(C)N1CCCN(CC1)C(=O)C2CCCCC2

DOS

IR

Vibrations