Geometry & MOs

Info

ID:	211628
PubChem CID:	81044575
Reduced:	NOC8H16 (2)
Stoich.:	ABC8D16 (2)
Weight, g/mol:	289.167794
ΔH_f, kcal/mol:	-138.1
Dipole, Da:	5.14
IP(EA), eV:	-8.81(1.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(3-hydroxyprop-1-ynyl)-N,2-dimethyl-N-(2-propan-2-yloxyethyl)benzamide

Drug info:

PubChemData

Smile

CC(C)COCCCNC(=O)CC(C)C1CCCNC1

DOS

IR

Vibrations