Geometry & MOs

Info

ID:	275240
PubChem CID:	103814753
Reduced:	ON3C14H21 (1)
Stoich.:	AB3C14D21 (1)
Weight, g/mol:	227.109233
ΔH_f, kcal/mol:	-30.53
Dipole, Da:	3.15
IP(EA), eV:	-8.89(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-3-methyl-N-[(5-methyl-1,3-thiazol-2-yl)methyl]butanamide

Drug info:

PubChemData

Smile

CC1=NC(=CC=C1)CN(C)C(=O)[C@H]2CCCCN2

DOS

IR

Vibrations