Geometry & MOs

Info

ID:	149576
PubChem CID:	53789250
Reduced:	SN2O5C27H30 (1)
Stoich.:	AB2C5D27E30 (1)
Weight, g/mol:	131.094629
ΔH_f, kcal/mol:	-164.67
Dipole, Da:	1.86
IP(EA), eV:	-8.65(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methylbutan-2-yl carbamate

Drug info:

PubChemData

Smile

CC(=O)OCC1(CCCC(O1)CSC2=NC(=C(N2)C3=CC=CC=C3)C4=CC=CC=C4)COC(=O)C

DOS

IR

Vibrations