Geometry & MOs

Info

ID:	190097
PubChem CID:	77953057
Reduced:	PN6O7C19H25 (1)
Stoich.:	AB6C7D19E25 (1)
Weight, g/mol:	276.220164
ΔH_f, kcal/mol:	-255.76
Dipole, Da:	5.24
IP(EA), eV:	-9.68(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1-adamantyl)-2-amino-N-(cyclopropylmethyl)-N-methylacetamide

Drug info:

PubChemData

Smile

CC1(C(C(OC1N2CCC(=O)NC2=O)COP(=O)(NC3CC3)OC4=CC=CC=C4)O)N=[N+]=[N-]

DOS

IR

Vibrations