Geometry & MOs

Info

ID:	150469
PubChem CID:	53790159
Reduced:	S2N6O6C21H24 (1)
Stoich.:	A2B6C6D21E24 (1)
Weight, g/mol:	176.068473
ΔH_f, kcal/mol:	-130.63
Dipole, Da:	3.72
IP(EA), eV:	-9.3(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methylpropoxycarbonyloxymethyl formate

Drug info:

PubChemData

Smile

CC(C1=CCC=CC1)C(=O)NC2[C@H]3N(C2=O)C(=C(CS3)C(C)(CC(=O)O)SC4=NNN=N4)C(=O)O

DOS

IR

Vibrations