Geometry & MOs

Info

ID:	281654
PubChem CID:	103914176
Reduced:	N2O4C13H26 (1)
Stoich.:	A2B4C13D26 (1)
Weight, g/mol:	294.194343
ΔH_f, kcal/mol:	-201.59
Dipole, Da:	1.61
IP(EA), eV:	-9.7(1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[3-(3,5-dimethylphenoxy)-2-hydroxypropyl]amino]-3-methylbutanamide

Drug info:

PubChemData

Smile

CC(C)C(C(=O)N)NCC(COCC1CCCO1)O

DOS

IR

Vibrations