Geometry & MOs

Info

ID:	69933
PubChem CID:	47205798
Reduced:	ON2C6H10 (2)
Stoich.:	AB2C6D10 (2)
Weight, g/mol:	326.06299
ΔH_f, kcal/mol:	-65.63
Dipole, Da:	2.14
IP(EA), eV:	-9.41(0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[1-(4-bromophenyl)ethylamino]-2-oxoethyl]butanamide

Drug info:

PubChemData

Smile

CCCC(=O)NCC(=O)N(C)CC1=CN(N=C1)C

DOS

IR

Vibrations