Geometry & MOs

Info

ID:	227453
PubChem CID:	87561782
Reduced:	O5C11H21 (2)
Stoich.:	A5B11C21 (2)
Weight, g/mol:	146.105528
ΔH_f, kcal/mol:	-435.11
Dipole, Da:	2.16
IP(EA), eV:	-10.76(-1.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(methylamino)butyl carbamate

Drug info:

PubChemData

Smile

CCCCCC(OCC)(OCC)OC(=O)OOC(=O)OC(CCCCC)(OCC)OCC

DOS

IR

Vibrations