Geometry & MOs

Info

ID:	144771
PubChem CID:	53410688
Reduced:	ClN2O2C6H15 (1)
Stoich.:	AB2C2D6E15 (1)
Weight, g/mol:	311.148121
ΔH_f, kcal/mol:	-125.98
Dipole, Da:	2.61
IP(EA), eV:	-9.18(0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-methoxy-5-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]pyridin-4-yl]methylcarbamic acid

Drug info:

PubChemData

Smile

CNCC(=O)N(C)CCO.Cl

DOS

IR

Vibrations