Geometry & MOs

Info

ID:	284444
PubChem CID:	104046549
Reduced:	NSO2C12H21 (1)
Stoich.:	ABC2D12E21 (1)
Weight, g/mol:	267.1293
ΔH_f, kcal/mol:	-86.16
Dipole, Da:	2.13
IP(EA), eV:	-8.48(0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-cyclopropyl-2-[(2-methyl-2-thiophen-2-ylpropyl)amino]acetate

Drug info:

PubChemData

Smile

COC(=O)C(C1CC1)NCC2CCSCC2

DOS

IR

Vibrations