Geometry & MOs

Info

ID:	288540
PubChem CID:	104319090
Reduced:	NO2C10H21 (1)
Stoich.:	AB2C10D21 (1)
Weight, g/mol:	200.152478
ΔH_f, kcal/mol:	-112.42
Dipole, Da:	1.79
IP(EA), eV:	-8.99(2.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-hydroxybutyl)-3-methyl-1,4-diazepan-2-one

Drug info:

PubChemData

Smile

CC(C)C1(CN(C1)CCC(C)O)O

DOS

IR

Vibrations