Geometry & MOs

Info

ID:	281750
PubChem CID:	103914308
Reduced:	OSN4C11H16 (1)
Stoich.:	ABC4D11E16 (1)
Weight, g/mol:	266.163043
ΔH_f, kcal/mol:	3.15
Dipole, Da:	3.78
IP(EA), eV:	-8.94(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[2-hydroxy-2-(3-methoxyphenyl)ethyl]amino]-3-methylbutanamide

Drug info:

PubChemData

Smile

CC(C)C(C(=O)N)NCC1=CN2C=CSC2=N1

DOS

IR

Vibrations