Geometry & MOs

Info

ID:	269424
PubChem CID:	103617422
Reduced:	ClIN2O2C12H12 (1)
Stoich.:	ABC2D2E12F12 (1)
Weight, g/mol:	381.02258
ΔH_f, kcal/mol:	-58.4
Dipole, Da:	4.41
IP(EA), eV:	-9.81(-1.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopropyl-N-(furan-2-ylmethyl)-2-iodo-3-methylbenzamide

Drug info:

PubChemData

Smile

C1CC(N(C1)C(=O)C2=C(C=CC(=C2)Cl)I)C(=O)N

DOS

IR

Vibrations