Geometry & MOs

Info

ID:	232677
PubChem CID:	87576699
Reduced:	NSO5C8H15 (1)
Stoich.:	ABC5D8E15 (1)
Weight, g/mol:	185.141579
ΔH_f, kcal/mol:	-212.55
Dipole, Da:	6.02
IP(EA), eV:	-8.61(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-amino-3,3-dimethylbutyl) 2-methylprop-2-enoate

Drug info:

PubChemData

Smile

CCS(=O)CC[C@@H](C(=O)OC)NC(=O)O

DOS

IR

Vibrations