Geometry & MOs

Info

ID:	289975
PubChem CID:	104393462
Reduced:	O2N3C11H21 (1)
Stoich.:	A2B3C11D21 (1)
Weight, g/mol:	215.163377
ΔH_f, kcal/mol:	-117.45
Dipole, Da:	3.93
IP(EA), eV:	-9.22(0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-N-[1-oxo-1-(propan-2-ylamino)propan-2-yl]butanamide

Drug info:

PubChemData

Smile

CC(C)NC(=O)C(C)NC(=O)C1CCNC1

DOS

IR

Vibrations