Geometry & MOs

Info

ID:	258484
PubChem CID:	103154379
Reduced:	O2N3C12H19 (1)
Stoich.:	A2B3C12D19 (1)
Weight, g/mol:	214.168128
ΔH_f, kcal/mol:	-59.02
Dipole, Da:	3.39
IP(EA), eV:	-9.27(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-N-(1-cyclopropylethyl)-3-methoxy-N-methylbutanamide

Drug info:

PubChemData

Smile

CN(CC1=CC=CC=N1)C(=O)CC(CN)OC

DOS

IR

Vibrations