Geometry & MOs

Info

ID:	330486
PubChem CID:	127247893
Reduced:	O2N5C14H23 (1)
Stoich.:	A2B5C14D23 (1)
Weight, g/mol:	306.136176
ΔH_f, kcal/mol:	-52.54
Dipole, Da:	5.03
IP(EA), eV:	-8.78(0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(methanesulfonamido)acetyl]-N,4-dimethyl-1,4-diazepane-6-carboxamide

Drug info:

PubChemData

Smile

CC1=NN(C=C1C(=O)N2CCN(CC(C2)C(=O)NC)C)C

DOS

IR

Vibrations