Geometry & MOs

Info

ID:	182485
PubChem CID:	76893541
Reduced:	ON2C16H26 (1)
Stoich.:	AB2C16D26 (1)
Weight, g/mol:	258.194343
ΔH_f, kcal/mol:	-59.19
Dipole, Da:	3.72
IP(EA), eV:	-9.23(0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-[(2-amino-3,3-dimethylbutanoyl)amino]heptanoic acid

Drug info:

PubChemData

Smile

CCN(CC1=CC=CC=C1C)C(=O)C(C(C)(C)C)N

DOS

IR

Vibrations