Geometry & MOs

Info

ID:	273620
PubChem CID:	103771495
Reduced:	NO3C16H21 (1)
Stoich.:	AB3C16D21 (1)
Weight, g/mol:	216.183778
ΔH_f, kcal/mol:	-111.47
Dipole, Da:	5.63
IP(EA), eV:	-9.33(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(dimethylamino)-N-(2-hydroxy-4-methylpentyl)propanamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations