Geometry & MOs

Info

ID:	281510
PubChem CID:	103913973
Reduced:	O2N3C12H23 (1)
Stoich.:	A2B3C12D23 (1)
Weight, g/mol:	263.155515
ΔH_f, kcal/mol:	-80.91
Dipole, Da:	0.96
IP(EA), eV:	-9.13(0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(1,1-dioxothian-3-yl)amino]-4,4-dimethylpentan-2-ol

Drug info:

PubChemData

Smile

CC(C1=NC=CN1C)NCC(C)(CCOC)O

DOS

IR

Vibrations