Geometry & MOs

Info

ID:	1174
PubChem CID:	3910
Reduced:	O2N3C10H19 (2)
Stoich.:	A2B3C10D19 (2)
Weight, g/mol:	426.295454
ΔH_f, kcal/mol:	-203.91
Dipole, Da:	4.35
IP(EA), eV:	-9.36(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-acetamido-N-[1-[[5-(diaminomethylideneamino)-1-oxopentan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]-4-methylpentanamide

Drug info:

PubChemData

Smile

CC(C)CC(C(=O)NC(CC(C)C)C(=O)NC(CCCN=C(N)N)C=O)NC(=O)C

DOS

IR

Vibrations