Geometry & MOs

Info

ID:	213645
PubChem CID:	81064479
Reduced:	NO4C15H17 (1)
Stoich.:	AB4C15D17 (1)
Weight, g/mol:	264.147393
ΔH_f, kcal/mol:	-141.54
Dipole, Da:	3.67
IP(EA), eV:	-9.33(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[3-(dimethylamino)benzoyl]amino]-3-methylbutanoic acid

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1)OC(=C2)C(=O)NCC(C)CC(=O)O

DOS

IR

Vibrations