Geometry & MOs

Info

ID:	197181
PubChem CID:	78933655
Reduced:	NO3C16H25 (1)
Stoich.:	AB3C16D25 (1)
Weight, g/mol:	293.199094
ΔH_f, kcal/mol:	-147.54
Dipole, Da:	3.72
IP(EA), eV:	-9.03(0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-[(1S)-1-hydroxypropyl]phenoxy]-N-pentan-2-ylpropanamide

Drug info:

PubChemData

Smile

CCC(C)(C)NC(=O)C(C)OC1=CC=CC(=C1)[C@H](C)O

DOS

IR

Vibrations