Geometry & MOs

Info

ID:	312400
PubChem CID:	126604632
Reduced:	N2O9C20H30 (1)
Stoich.:	A2B9C20D30 (1)
Weight, g/mol:	205.110279
ΔH_f, kcal/mol:	-301.75
Dipole, Da:	2.53
IP(EA), eV:	-9.03(0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-hydroxybutylimino)-1-phenylethanone

Drug info:

PubChemData

Smile

CC1C([C@H](OC(C1O)CO)O[C@@H]2C(C(C(O[C@]23C=C3NCC#C)OC)O)O)NC(=O)C

DOS

IR

Vibrations