Geometry & MOs

Info

ID:	252347
PubChem CID:	103110711
Reduced:	BrN3C14H16 (1)
Stoich.:	AB3C14D16 (1)
Weight, g/mol:	278.174276
ΔH_f, kcal/mol:	45.15
Dipole, Da:	4.59
IP(EA), eV:	-8.51(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-2-[[4-[(Z)-N'-hydroxycarbamimidoyl]phenyl]methylamino]-N-methylpropanamide

Drug info:

PubChemData

Smile

CC1=CC(=CN=C1NCC2=C(C(=CC=C2)N)C)Br

DOS

IR

Vibrations