Geometry & MOs

Info

ID:	287328
PubChem CID:	104236927
Reduced:	ClN2O2C14H17 (1)
Stoich.:	AB2C2D14E17 (1)
Weight, g/mol:	299.103669
ΔH_f, kcal/mol:	-12.23
Dipole, Da:	5.12
IP(EA), eV:	-9.24(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-carbamoyl-2-[2-chloro-4-[1-(methylamino)ethyl]phenoxy]propanamide

Drug info:

PubChemData

Smile

CC1=NOC(=C1)COC2=C(C=C(C=C2)C(C)NC)Cl

DOS

IR

Vibrations