Geometry & MOs

Info

ID:	290168
PubChem CID:	104416850
Reduced:	ON3C13H21 (1)
Stoich.:	AB3C13D21 (1)
Weight, g/mol:	315.05824
ΔH_f, kcal/mol:	-50.81
Dipole, Da:	3.6
IP(EA), eV:	-7.98(0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2-amino-5-bromoanilino)-N-(2-methoxyethyl)propanamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)N)NCCC(=O)NC(C)C

DOS

IR

Vibrations