Geometry & MOs

Info

ID:	69572
PubChem CID:	47193868
Reduced:	BrClOSN2C14H14 (1)
Stoich.:	ABCDE2F14G14 (1)
Weight, g/mol:	376.02839
ΔH_f, kcal/mol:	-8.94
Dipole, Da:	1.06
IP(EA), eV:	-8.72(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

propan-2-yl 3-[(4-iodophenyl)carbamoylamino]propanoate

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)NC(=O)NCCC2=CC=C(S2)Br)Cl

DOS

IR

Vibrations